data_2kb8_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 2kb8 _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 ' 4' ' ' THR . . . . . 0.606 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 1.3 p . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.592 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -49.54 -18.5 0.43 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 120.35 -1.469 . . . . 0.0 108.112 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.489 ' N ' ' C ' ' A' ' 4' ' ' THR . 74.8 m -92.44 -71.42 0.65 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.385 -0.822 . . . . 0.0 110.04 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -34.56 76.16 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.553 -0.717 . . . . 0.0 109.225 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.606 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -66.79 -56.11 11.9 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.37 -0.932 . . . . 0.0 109.535 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.554 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 42.0 p -55.61 -27.66 50.73 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.036 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -33.0 71.81 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.488 -0.757 . . . . 0.0 110.068 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.485 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 tpp180 -87.38 -44.61 11.24 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.474 ' HB2' ' HA ' ' A' ' 9' ' ' THR . 6.6 mp -54.92 -34.05 62.78 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.598 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.499 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.65 -30.69 68.45 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.764 0.793 . . . . 0.0 109.241 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.13 -40.89 82.43 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.405 -0.81 . . . . 0.0 109.269 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.533 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.4 m-85 -83.64 -16.11 46.39 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 mt -68.39 -49.7 58.2 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.421 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 22.7 t -76.32 -25.51 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.426 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -89.44 -57.94 2.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.214 -0.929 . . . . 0.0 110.629 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.6 t -54.92 -33.43 62.13 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.416 -0.802 . . . . 0.0 111.852 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 O-C-N 120.763 -1.211 . . . . 0.0 111.532 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.594 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.7 m . . . . . 0 C--O 1.213 -0.84 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -34.98 -25.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 120.908 0.385 . . . . 0.0 110.985 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.594 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.0 t -74.0 -40.21 63.09 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 120.946 -1.096 . . . . 0.0 109.479 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' N ' ' O ' ' A' ' 4' ' ' THR . 21.2 t -74.42 -59.77 2.58 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.209 -0.932 . . . . 0.0 109.387 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.89 -46.78 52.09 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.969 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.508 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 6.8 m -57.31 -43.65 83.47 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.165 -0.959 . . . . 0.0 109.184 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.433 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -64.24 -25.38 68.04 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.399 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.11 -43.01 11.37 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -61.38 -30.38 70.5 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.88 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.528 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -68.22 -37.8 81.23 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.755 0.788 . . . . 0.0 109.279 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -41.33 85.42 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.651 -0.656 . . . . 0.0 109.526 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -79.92 -22.05 43.19 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.528 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -60.3 -36.71 78.5 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.164 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.0 t -90.49 -33.36 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.774 . . . . 0.0 109.952 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -80.89 -36.85 30.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.277 -0.89 . . . . 0.0 110.338 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 22.8 t -90.13 -40.45 12.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.118 -0.989 . . . . 0.0 112.302 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 16' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.498 1.94 0 O-C-N 120.809 -1.182 . . . . 0.0 112.892 -177.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.614 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 3.2 p . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.521 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -46.12 -24.8 0.49 Allowed 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 118.299 -1.36 . . . . 0.0 107.918 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.47 ' N ' ' C ' ' A' ' 4' ' ' THR . 4.3 m -92.71 -76.79 0.46 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.581 -0.699 . . . . 0.0 109.812 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.9 m -60.16 -40.47 89.99 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.571 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.614 ' HB3' ' HA ' ' A' ' 4' ' ' THR . . . -64.61 -48.72 73.86 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 118.886 -1.126 . . . . 0.0 108.919 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.3 m -51.15 -41.85 60.39 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 118.432 -1.307 . . . . 0.0 108.049 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.454 ' O ' ' HB2' ' A' ' 14' ' ' ASN . 3.6 tp60 -65.52 -21.68 66.64 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 121.446 -0.784 . . . . 0.0 110.661 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.588 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.08 -50.87 5.61 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 179.201 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -42.18 98.54 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.762 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -68.77 -27.52 65.97 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.484 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.7 t30 -55.9 -41.11 74.01 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.588 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 2.2 m-85 -88.96 -16.92 30.58 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 tp -72.38 -41.42 66.35 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.354 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -86.17 -27.48 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.858 . . . . 0.0 109.738 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 12.7 m170 -84.06 -49.49 8.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.278 -0.889 . . . . 0.0 109.928 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 p -71.01 -24.54 62.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.302 -0.874 . . . . 0.0 110.645 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 11.3 t . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.106 -0.996 . . . . 0.0 110.394 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.534 ' O ' ' N ' ' A' ' 7' ' ' CYS . 75.9 p . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.465 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -42.23 -22.49 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.494 -0.754 . . . . 0.0 109.86 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.52 ' N ' ' O ' ' A' ' 4' ' ' THR . 1.8 t -77.79 -29.3 50.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.0 109.884 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.9 t -89.31 -63.69 1.25 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.189 -0.944 . . . . 0.0 109.634 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.477 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -44.58 -51.49 8.94 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.355 -0.841 . . . . 0.0 108.995 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 99.0 m -57.65 -48.06 80.52 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.199 -0.938 . . . . 0.0 109.342 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.77 -17.41 64.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.243 -0.911 . . . . 0.0 110.63 179.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.468 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 3.2 ttm180 -91.19 -43.24 9.97 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 8' ' ' ALA . 3.9 mm? -66.2 -37.08 84.74 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.189 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.487 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.26 -29.54 66.35 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.541 -0.724 . . . . 0.0 109.192 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.477 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -60.78 -43.83 97.57 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.608 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.97 -23.56 31.0 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.487 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -58.71 -58.33 9.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.396 -0.815 . . . . 0.0 109.862 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.1 -32.53 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.373 -0.83 . . . . 0.0 110.299 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.477 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.8 m170 -81.47 -68.16 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.19 -0.944 . . . . 0.0 110.288 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 8.5 t -39.32 -40.17 0.75 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.004 -0.678 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 C--N 1.297 -1.707 0 O-C-N 120.951 -1.093 . . . . 0.0 109.969 179.931 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.643 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -44.93 -22.05 0.08 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.534 -1.354 . . . . 0.0 108.748 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.523 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -91.4 -75.29 0.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.328 -0.858 . . . . 0.0 110.941 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -63.19 -25.9 68.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.912 -1.117 . . . . 0.0 109.49 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.643 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -70.65 -56.99 5.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.741 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 44.5 p -56.58 -28.27 59.87 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.386 -1.326 . . . . 0.0 107.902 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 4.5 mm100 -78.28 -22.15 48.68 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.553 0.692 . . . . 0.0 109.616 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.07 -42.04 13.37 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 3.7 mm? -57.3 -45.05 84.52 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.55 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.9 -22.28 65.09 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -63.88 -45.31 89.97 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.559 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 9.0 m-85 -65.94 -23.41 66.6 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -55.35 -40.27 71.06 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.9 t -85.65 -44.97 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 120.109 -0.637 . . . . 0.0 109.955 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.412 ' HB2' ' HA ' ' A' ' 15' ' ' PHE . 21.9 m-70 -66.84 -50.03 63.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.217 -0.927 . . . . 0.0 109.693 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.2 t -55.51 -53.34 57.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 0.0 109.711 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.374 -0.828 . . . . 0.0 109.9 179.682 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.532 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -40.41 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.651 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.532 ' N ' ' O ' ' A' ' 4' ' ' THR . 4.7 t -67.36 -39.13 85.68 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 108.782 178.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.6 t -79.25 -47.61 15.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.25 77.37 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 18.7 m -56.14 -39.61 72.53 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -69.1 -19.25 64.05 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.65 0.738 . . . . 0.0 109.418 178.735 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 1.7 mmm180 -87.61 -51.28 5.98 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 105.264 -2.124 . . . . 0.0 105.264 177.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.48 ' O ' HD12 ' A' ' 16' ' ' LEU . 10.6 mt -56.08 -29.94 61.29 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.78 -26.1 62.29 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 30.6 t-20 -58.94 -46.76 87.19 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CB ' ' A' ' 19' ' ' SER . 2.1 m-85 -76.94 -21.18 55.19 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 mp -67.33 -67.58 0.44 Allowed 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.176 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.437 HG13 ' O ' ' A' ' 17' ' ' VAL . 71.8 t -58.63 -26.31 30.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 110.445 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.495 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 31.3 m-70 -88.56 -52.8 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.187 -0.946 . . . . 0.0 111.298 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.0 p -68.81 -32.62 72.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.281 -0.887 . . . . 0.0 110.145 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.525 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 59.7 m . . . . . 0 N--CA 1.489 1.518 0 O-C-N 120.997 -1.065 . . . . 0.0 109.1 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.525 ' O ' ' N ' ' A' ' 6' ' ' THR . 14.7 p . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.499 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -39.88 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.679 -0.638 . . . . 0.0 109.555 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.527 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 6.1 t -64.37 -42.45 96.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' CG2' ' A' ' 6' ' ' THR . 5.3 t -84.12 -42.99 15.46 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.46 ' O ' HD21 ' A' ' 12' ' ' LEU . . . -60.82 -53.38 58.06 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.499 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 85.3 m -55.55 -38.59 69.5 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.875 -1.13 . . . . 0.0 108.147 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -71.13 -21.26 62.22 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.846 0.832 . . . . 0.0 109.394 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -87.01 -43.03 12.65 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.513 ' N ' HD21 ' A' ' 12' ' ' LEU . 2.3 mm? -57.57 -39.57 77.03 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.791 176.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.499 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.82 -28.34 67.48 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.63 -43.32 97.65 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.507 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -75.81 -17.85 59.7 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.045 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.543 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.7 OUTLIER -67.11 -38.66 86.01 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.591 -0.844 . . . . 0.0 108.978 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -86.41 -29.2 5.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.592 -0.692 . . . . 0.0 109.335 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -85.1 -51.56 6.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.369 -0.832 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.3 p -68.81 -39.92 79.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.812 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 7.8 t . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.192 -0.943 . . . . 0.0 110.037 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.544 ' HB ' HG22 ' A' ' 6' ' ' THR . 3.0 m . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.504 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.53 -24.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.264 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.544 HG22 ' HB ' ' A' ' 4' ' ' THR . 14.9 t -74.61 -40.77 61.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.211 -0.931 . . . . 0.0 109.372 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' N ' ' O ' ' A' ' 4' ' ' THR . 9.4 t -77.31 -57.79 3.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.423 -0.798 . . . . 0.0 109.829 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.83 -46.27 51.0 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.385 -0.822 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.504 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 22.1 m -64.77 -44.16 90.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.818 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -78.15 -10.95 59.87 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.362 -0.836 . . . . 0.0 111.122 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.6 OUTLIER -91.38 -51.72 5.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 7.5 mt -58.51 -45.22 89.24 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.869 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 9' ' ' THR . . . -64.52 -27.4 68.94 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 20.1 t-20 -53.36 -46.92 69.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -90.68 -20.14 22.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.535 -0.728 . . . . 0.0 109.07 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.476 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -70.68 -40.4 72.95 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.507 -0.877 . . . . 0.0 109.629 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.1 t -84.64 -29.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.303 -0.873 . . . . 0.0 109.619 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.495 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 9.9 m170 -85.86 -47.52 9.61 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.465 -0.772 . . . . 0.0 110.924 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -78.22 -22.95 47.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.244 -0.91 . . . . 0.0 111.692 -178.555 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 4.2 p . . . . . 0 N--CA 1.491 1.611 0 O-C-N 120.592 -1.318 . . . . 0.0 111.423 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.605 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 1.5 m . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 120.557 0.218 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.542 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . -43.86 -21.92 0.05 OUTLIER 'General case' 0 C--N 1.295 -1.796 0 O-C-N 120.818 -1.176 . . . . 0.0 109.542 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.7 p -91.47 -85.84 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.134 -0.979 . . . . 0.0 110.595 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 2.1 m -55.82 -30.45 61.42 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.538 -0.726 . . . . 0.0 109.625 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.605 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -74.63 -58.9 2.99 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.114 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.565 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.5 t -50.67 -27.15 6.42 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 118.347 -1.341 . . . . 0.0 109.623 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -35.71 72.78 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.581 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 14.4 ttp180 -88.21 -39.73 14.25 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.1 mm? -64.24 -25.99 68.31 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.077 176.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.56 -43.18 81.28 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 121.725 0.774 . . . . 0.0 109.719 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.546 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 40.7 t30 -56.32 -42.66 78.01 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.561 0.696 . . . . 0.0 109.639 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -86.65 -12.98 46.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -69.5 -40.4 77.02 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.284 -0.966 . . . . 0.0 108.967 179.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.3 t -80.73 -33.06 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.297 -0.877 . . . . 0.0 109.256 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -81.97 -48.78 11.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.462 -0.774 . . . . 0.0 110.495 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.6 t -70.75 -50.4 36.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.212 -0.93 . . . . 0.0 110.794 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 3.4 t . . . . . 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.329 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.555 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -38.73 -28.98 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.51 0.672 . . . . 0.0 109.689 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.551 HG23 ' CG2' ' A' ' 4' ' ' THR . 9.4 t -67.01 -44.91 79.1 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.2 OUTLIER -72.25 -39.08 68.71 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.097 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.474 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -62.45 -53.51 53.73 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.494 ' O ' ' N ' ' A' ' 13' ' ' ALA . 18.2 m -57.39 -33.81 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.518 ' NE2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.8 -27.73 66.13 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.47 -0.769 . . . . 0.0 109.803 179.273 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -87.56 -47.12 8.96 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -58.99 -22.57 60.76 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.146 176.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.53 -37.71 65.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.885 0.85 . . . . 0.0 109.287 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -57.82 -42.5 84.43 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.582 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -81.64 -17.22 48.88 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.804 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 5.6 mt -66.04 -61.04 2.26 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.85 -1.14 . . . . 0.0 108.508 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -56.34 -41.98 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.773 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -72.84 -56.67 4.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.39 -0.819 . . . . 0.0 110.528 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.571 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.4 t -65.6 -50.52 64.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.291 -0.88 . . . . 0.0 110.618 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 70.7 m . . . . . 0 N--CA 1.493 1.709 0 O-C-N 121.097 -1.002 . . . . 0.0 109.428 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.53 ' O ' ' N ' ' A' ' 7' ' ' CYS . 3.1 m . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.57 -27.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.337 0.589 . . . . 0.0 109.816 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.555 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 5.2 t -67.72 -45.08 76.09 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.219 -0.925 . . . . 0.0 108.619 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' CG2' ' A' ' 6' ' ' THR . 38.9 t -76.53 -49.97 15.11 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.318 -0.864 . . . . 0.0 108.733 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.444 ' O ' HD11 ' A' ' 12' ' ' LEU . . . -51.62 -51.07 58.6 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.478 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.7 m -59.71 -45.97 90.51 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.426 -0.796 . . . . 0.0 108.952 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.541 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -69.63 -13.17 62.17 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.155 -0.966 . . . . 0.0 109.96 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -91.1 -52.85 4.63 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.444 HD11 ' O ' ' A' ' 8' ' ' ALA . 4.1 mp -52.0 -42.43 63.0 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.47 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.61 -31.17 72.25 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 3.7 t-20 -53.26 -52.67 58.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 2.6 m-85 -60.92 -22.03 63.97 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.553 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.6 tp -75.77 -38.66 58.15 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.696 0.76 . . . . 0.0 109.149 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.7 t -88.32 -36.35 9.11 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.235 -0.915 . . . . 0.0 109.366 179.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.46 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.4 m-70 -74.65 -52.85 10.57 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.13 -0.981 . . . . 0.0 111.153 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.93 -31.37 15.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.245 -0.909 . . . . 0.0 112.273 -178.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.75 0 O-C-N 120.746 -1.221 . . . . 0.0 112.648 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.564 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.21 -0.978 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -41.61 -23.32 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.541 ' N ' ' O ' ' A' ' 4' ' ' THR . 4.5 t -72.32 -39.88 67.87 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 4' ' ' THR . 43.6 t -70.03 -40.26 75.29 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.75 -48.41 63.8 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.519 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 5.5 m -57.71 -32.63 67.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 4.9 tt0 -69.26 -25.19 64.14 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.74 0.781 . . . . 0.0 109.687 179.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -88.64 -53.55 4.58 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.288 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -50.3 -37.83 38.37 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 175.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.72 -31.45 72.62 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -50.98 -44.55 60.81 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.2 m-85 -91.59 -26.79 18.55 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.543 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.75 -43.87 67.93 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 118.619 -1.232 . . . . 0.0 108.693 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.9 t -73.51 -31.64 33.56 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.256 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -85.18 -36.56 20.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.416 -0.803 . . . . 0.0 110.693 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.5 t -89.4 -20.36 24.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.182 -0.949 . . . . 0.0 111.416 -178.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 20.2 m . . . . . 0 N--CA 1.495 1.794 0 O-C-N 120.758 -1.214 . . . . 0.0 110.641 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.545 ' CG2' HG23 ' A' ' 6' ' ' THR . 2.5 m . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -39.69 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.545 HG23 ' CG2' ' A' ' 4' ' ' THR . 8.9 t -73.76 -40.27 63.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.519 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.0 t -72.31 -54.42 9.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.608 -0.682 . . . . 0.0 109.91 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.22 -36.6 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 109.357 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 40.9 m -73.43 -42.98 61.35 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.404 -0.81 . . . . 0.0 109.381 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.502 ' HG2' ' HA ' ' A' ' 7' ' ' CYS . 3.9 pt20 -83.28 -5.26 59.07 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 121.362 -0.836 . . . . 0.0 110.472 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.527 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -90.43 -51.71 5.28 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.8 mt -63.47 -49.33 74.06 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.035 176.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.436 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.15 -21.79 65.34 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.56 ' OD1' ' CD2' ' A' ' 18' ' ' HIS . 4.1 t-20 -55.98 -59.59 4.69 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.6 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -57.26 -22.95 45.04 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.658 -1.217 . . . . 0.0 108.036 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.46 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.0 OUTLIER -74.72 -41.24 60.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.64 -0.824 . . . . 0.0 109.28 179.117 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.9 t -90.33 -42.81 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.212 -0.93 . . . . 0.0 110.033 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.56 ' CD2' ' OD1' ' A' ' 14' ' ' ASN . 6.2 m-70 -67.67 -36.94 81.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.427 -0.796 . . . . 0.0 110.843 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -90.17 -42.64 10.94 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.348 -178.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.46 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.296 -1.737 0 O-C-N 121.02 -1.05 . . . . 0.0 112.9 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.569 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.475 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -42.6 -16.59 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.316 -0.865 . . . . 0.0 111.365 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.569 ' CG2' ' HB ' ' A' ' 4' ' ' THR . 3.3 t -87.33 -30.41 20.85 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.027 -1.046 . . . . 0.0 108.285 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' HG22 ' A' ' 6' ' ' THR . 11.8 p -85.12 -38.13 19.43 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -64.69 -46.92 80.34 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.476 ' O ' ' HB1' ' A' ' 13' ' ' ALA . 3.3 p -58.79 -42.11 88.29 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.483 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 11.5 mm-40 -75.57 -13.93 60.37 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 121.507 0.67 . . . . 0.0 109.804 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.446 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 12.4 tpp180 -90.12 -43.09 10.7 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -62.27 -44.54 96.3 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.557 -1.201 . . . . 0.0 108.767 177.183 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.7 -25.6 67.39 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.523 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t30 -58.79 -44.35 90.7 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.89 -19.59 34.51 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.547 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.3 tp -71.87 -63.9 1.04 Allowed 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.218 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.44 -25.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.045 . . . . 0.0 109.697 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 16.0 m-70 -86.66 -53.03 5.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.251 -0.906 . . . . 0.0 110.648 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -79.56 -25.12 41.69 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.268 -0.895 . . . . 0.0 111.278 -178.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.6 t . . . . . 0 N--CA 1.494 1.761 0 O-C-N 121.02 -1.05 . . . . 0.0 110.847 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.551 ' CG2' HG21 ' A' ' 6' ' ' THR . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.516 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.93 -21.29 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.551 HG21 ' CG2' ' A' ' 4' ' ' THR . 7.2 t -75.6 -37.74 59.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.093 -1.005 . . . . 0.0 109.644 179.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.487 ' HB3' HG23 ' A' ' 4' ' ' THR . 36.0 t -83.15 -62.52 1.57 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.747 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -43.22 -63.33 0.83 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.124 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.535 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 91.9 m -48.5 -42.05 31.74 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.793 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.515 ' HB2' ' O ' ' A' ' 6' ' ' THR . 6.2 tt0 -61.07 -31.6 71.26 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 121.044 -1.035 . . . . 0.0 110.949 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' CG ' ' CZ ' ' A' ' 15' ' ' PHE . 17.3 ttp85 -92.2 -44.98 8.48 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.833 -1.167 . . . . 0.0 107.853 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.488 HD11 ' N ' ' A' ' 12' ' ' LEU . 5.5 mp -61.83 -45.77 92.39 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.538 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.74 -28.67 68.6 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -54.04 -42.61 69.4 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.32 -18.31 28.76 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.657 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.528 ' O ' ' CB ' ' A' ' 20' ' ' SER . 6.7 tp -71.76 -36.57 70.44 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.444 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 t -87.83 -35.52 8.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.166 -0.959 . . . . 0.0 109.347 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 6.9 m-70 -79.29 -48.54 13.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.412 -0.805 . . . . 0.0 111.211 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -90.13 -29.68 18.14 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.917 -1.114 . . . . 0.0 112.287 -178.3 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 O-C-N 120.695 -1.253 . . . . 0.0 111.971 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.526 ' O ' ' N ' ' A' ' 7' ' ' CYS . 59.4 p . . . . . 0 N--CA 1.484 1.231 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.479 ' O ' HG21 ' A' ' 9' ' ' THR . . . -40.97 -25.18 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.953 -0.699 . . . . 0.0 109.544 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.525 HG22 ' CB ' ' A' ' 4' ' ' THR . 9.0 t -74.67 -35.73 62.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.412 -0.805 . . . . 0.0 109.91 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.6 t -80.07 -56.64 4.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.435 -0.791 . . . . 0.0 109.823 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -47.17 -62.86 1.22 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.119 -0.988 . . . . 0.0 108.768 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.578 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.4 p -52.93 -36.83 60.25 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.483 178.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -60.35 -32.69 71.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.78 -1.2 . . . . 0.0 110.232 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.49 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -91.76 -46.35 7.94 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.703 1.24 . . . . 0.0 107.805 179.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.9 mp -61.9 -57.47 11.64 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.048 178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.578 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -59.17 -26.45 64.78 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.591 ' O ' ' CG ' ' A' ' 18' ' ' HIS . 16.7 t-20 -47.98 -50.19 28.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 19' ' ' SER . 0.7 OUTLIER -92.96 -25.28 18.08 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.548 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.0 -37.96 75.83 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.892 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.412 ' CG2' ' HB2' ' A' ' 13' ' ' ALA . 11.1 t -87.69 -30.69 5.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 O-C-N 121.199 -0.938 . . . . 0.0 109.155 179.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.591 ' CG ' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -81.4 -47.12 13.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.6 -0.688 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -87.09 -31.81 20.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.128 -0.983 . . . . 0.0 111.7 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.088 . . . . 0.0 111.908 -179.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.54 ' O ' ' N ' ' A' ' 6' ' ' THR . 80.5 p . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -35.56 -30.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.35 0.595 . . . . 0.0 109.843 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.54 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.6 t -57.41 -45.93 84.03 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.9 t -89.14 -45.12 9.83 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.473 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -55.12 -54.3 44.92 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.541 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 28.2 m -57.81 -42.19 83.75 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.152 -0.967 . . . . 0.0 109.025 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 6' ' ' THR . 21.7 mm-40 -71.74 -18.22 62.15 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.176 -0.952 . . . . 0.0 109.977 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.573 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -90.49 -49.86 6.27 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 178.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -56.7 -46.43 81.24 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.614 176.81 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.52 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -60.35 -32.22 71.06 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.485 0.66 . . . . 0.0 109.268 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.569 ' O ' ' CD2' ' A' ' 18' ' ' HIS . 4.8 t-20 -57.88 -44.54 86.74 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.582 -0.699 . . . . 0.0 109.298 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.573 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 1.0 OUTLIER -87.82 -22.78 24.29 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.485 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -72.94 -53.15 12.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.251 -0.979 . . . . 0.0 109.19 179.724 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.49 -29.53 46.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.111 -0.993 . . . . 0.0 109.348 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 14' ' ' ASN . 10.7 m-70 -86.34 -57.82 2.86 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.351 -0.843 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.8 t -69.41 -26.66 64.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.466 -0.772 . . . . 0.0 111.664 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.7 t . . . . . 0 N--CA 1.492 1.671 0 O-C-N 121.032 -1.042 . . . . 0.0 110.892 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.552 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 1.4 p . . . . . 0 N--CA 1.481 1.084 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.474 ' O ' HG22 ' A' ' 9' ' ' THR . . . -38.48 -25.34 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.823 -0.548 . . . . 0.0 110.682 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.552 ' CG2' ' HB ' ' A' ' 4' ' ' THR . 1.5 t -72.61 -33.96 67.05 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.873 -1.142 . . . . 0.0 109.221 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' ' O ' ' A' ' 4' ' ' THR . 36.8 t -89.72 -38.07 14.11 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.271 -0.893 . . . . 0.0 108.807 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -60.35 -56.5 20.7 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 5' ' ' ALA . 81.5 p -60.14 -38.32 82.75 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.363 -0.935 . . . . 0.0 108.948 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.476 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -73.58 -19.83 60.77 Favored 'General case' 0 N--CA 1.486 1.342 0 O-C-N 121.225 -0.922 . . . . 0.0 110.201 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.0 tpm_? -90.71 -43.06 10.36 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.561 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -60.58 -41.14 94.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.493 177.135 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.52 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.44 -28.35 68.53 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.23 -47.9 77.55 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' O ' ' CB ' ' A' ' 19' ' ' SER . 7.0 m-85 -68.31 -21.35 64.77 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -64.47 -54.15 37.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.852 . . . . 0.0 109.727 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -72.77 -33.25 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.288 -0.883 . . . . 0.0 110.02 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -79.5 -58.47 3.19 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.138 -0.976 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.569 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 6.7 t -52.99 -22.95 6.32 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.001 -1.062 . . . . 0.0 110.077 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.5 t . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.895 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 7' ' ' CYS . 2.6 t . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 121.688 0.756 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.454 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.73 -25.94 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.615 -0.678 . . . . 0.0 109.911 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.536 HG23 ' CG2' ' A' ' 4' ' ' THR . 2.0 t -64.47 -39.8 94.49 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.541 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.2 t -89.72 -32.73 16.87 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.474 ' O ' HD13 ' A' ' 12' ' ' LEU . . . -66.31 -49.38 67.24 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.0 m -59.71 -39.22 83.9 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.9 OUTLIER -75.03 -20.01 59.78 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.501 -0.749 . . . . 0.0 109.519 178.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 7' ' ' CYS . 1.4 mmt85 -84.84 -41.93 15.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.534 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -59.04 -30.42 68.03 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.198 -1.365 . . . . 0.0 107.973 176.488 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.523 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.64 -35.24 78.53 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 122.003 0.906 . . . . 0.0 108.618 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -58.28 -45.64 87.55 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.1 m-85 -70.54 -19.94 62.85 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.523 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.0 OUTLIER -57.67 -32.32 67.2 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.6 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.6 -46.2 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.684 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -69.7 -47.52 62.87 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.177 -0.952 . . . . 0.0 109.824 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.7 t -64.25 -56.14 16.67 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.239 -0.913 . . . . 0.0 109.112 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.491 ' OG ' ' O ' ' A' ' 16' ' ' LEU . 82.1 p . . . . . 0 N--CA 1.488 1.45 0 O-C-N 121.228 -0.92 . . . . 0.0 109.083 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.586 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 3.5 m . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -46.71 -20.9 0.15 Allowed 'General case' 0 C--N 1.293 -1.88 0 O-C-N 120.358 -1.464 . . . . 0.0 108.615 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.1 m -92.49 -65.66 0.98 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.458 -0.776 . . . . 0.0 110.647 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -67.49 -32.87 73.98 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.305 -0.872 . . . . 0.0 108.956 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.586 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -66.31 -55.03 17.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.402 -0.811 . . . . 0.0 109.015 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 79.5 m -57.95 -28.65 64.5 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.596 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.476 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 10.4 mm-40 -88.49 -11.25 46.37 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 121.542 -0.724 . . . . 0.0 110.149 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 21.4 ttp180 -89.92 -48.35 7.28 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.52 -43.96 97.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.647 -1.16 . . . . 0.0 107.955 176.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.483 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.13 -22.48 66.94 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 21.8 t30 -58.17 -49.36 77.29 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 m-30 -63.82 -24.72 67.86 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.551 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -63.1 -49.92 72.53 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.397 179.377 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.2 t -81.46 -31.43 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.441 -0.787 . . . . 0.0 109.942 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -74.08 -57.12 4.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.412 -0.805 . . . . 0.0 110.187 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -69.48 -17.35 63.6 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.995 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 1.2 t . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.53 ' HB ' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.166 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.55 -25.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.62 0.724 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.53 HG23 ' HB ' ' A' ' 4' ' ' THR . 8.0 t -78.75 -44.61 22.96 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.498 -0.751 . . . . 0.0 109.525 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' HG22 ' A' ' 6' ' ' THR . 44.3 t -61.44 -47.16 87.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.463 -0.773 . . . . 0.0 109.185 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -56.95 -48.84 77.36 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.698 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.425 ' O ' ' N ' ' A' ' 13' ' ' ALA . 17.5 m -63.11 -42.48 99.58 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.51 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -66.29 -20.8 66.2 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.477 -0.764 . . . . 0.0 109.804 179.376 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -90.04 -48.87 6.92 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 178.551 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -58.77 -31.81 68.72 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.825 176.669 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.558 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.39 -27.99 61.77 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.796 0.808 . . . . 0.0 108.998 179.013 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.492 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 6.5 t-20 -60.45 -43.19 97.1 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.759 -0.588 . . . . 0.0 109.822 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.16 -16.53 33.13 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.162 179.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.3 mt -70.53 -49.29 49.69 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.815 -179.863 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.66 -36.43 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.413 -0.805 . . . . 0.0 109.852 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.492 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 27.5 m-70 -77.93 -55.78 5.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.455 -0.778 . . . . 0.0 111.279 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -75.76 -36.73 59.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.269 -0.894 . . . . 0.0 112.358 -178.047 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.758 -1.214 . . . . 0.0 112.456 -178.618 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.538 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.52 -23.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.826 -0.546 . . . . 0.0 110.177 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.538 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -77.65 -41.22 39.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.143 -0.973 . . . . 0.0 109.519 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.532 ' N ' HG23 ' A' ' 6' ' ' THR . 38.3 t -86.13 -48.78 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.145 178.951 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -54.1 -53.31 54.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.025 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 52.3 m -54.33 -42.91 70.74 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.719 178.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -74.23 -18.81 60.69 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.312 -0.867 . . . . 0.0 110.653 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.3 mmt85 -90.1 -37.88 13.94 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.271 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -68.3 -31.64 71.23 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.276 177.974 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.83 -32.45 67.55 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.758 0.79 . . . . 0.0 108.869 178.82 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 18.0 t30 -59.04 -44.02 91.72 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.424 0.63 . . . . 0.0 109.644 179.314 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -79.78 -16.93 54.6 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.168 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -68.29 -54.9 14.33 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.541 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -78.44 -19.86 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.332 -0.855 . . . . 0.0 110.105 179.652 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 15.1 m170 -88.6 -56.98 3.08 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.036 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.6 p -62.2 -21.03 64.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.432 -0.792 . . . . 0.0 110.587 -179.624 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.075 -1.015 . . . . 0.0 110.37 -179.977 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.534 ' CG2' HG23 ' A' ' 6' ' ' THR . 1.5 m . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.485 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -39.57 -25.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.69 -0.631 . . . . 0.0 110.043 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.534 HG23 ' CG2' ' A' ' 4' ' ' THR . 3.0 t -75.48 -34.08 60.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.951 . . . . 0.0 110.368 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.3 t -89.9 -60.86 1.82 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.962 . . . . 0.0 109.641 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -44.97 -54.37 6.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.867 . . . . 0.0 109.206 179.136 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 27.9 m -59.78 -43.45 94.37 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.458 -0.776 . . . . 0.0 110.076 179.579 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.52 65.1 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 121.187 -0.946 . . . . 0.0 110.555 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.604 ' HG3' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.12 -50.07 6.05 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.114 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 8' ' ' ALA 0.262 3.2 mt -58.27 -39.75 80.07 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.25 178.101 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.475 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.8 -34.29 77.82 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.523 -0.736 . . . . 0.0 109.429 179.246 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.496 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 7.4 t30 -56.24 -44.57 79.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.403 -0.81 . . . . 0.0 109.349 179.393 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.621 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -85.44 -20.03 30.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.919 . . . . 0.0 108.877 179.568 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' O ' ' HB3' ' A' ' 20' ' ' SER . 2.0 tp -66.13 -52.71 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.823 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 t -72.1 -30.88 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.163 -0.961 . . . . 0.0 110.29 179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 19.5 m-70 -89.8 -66.71 0.9 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.995 . . . . 0.0 110.878 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.2 t -50.95 -23.69 3.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 111.284 -178.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 9.1 p . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.863 -1.148 . . . . 0.0 111.43 -179.337 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.59 ' O ' ' N ' ' A' ' 8' ' ' ALA . 1.8 m . . . . . 0 N--CA 1.512 2.639 0 CA-C-O 120.754 0.312 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.54 ' N ' ' CG2' ' A' ' 4' ' ' THR . . . -43.53 -22.93 0.05 Allowed 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.567 -1.333 . . . . 0.0 108.995 179.58 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.2 OUTLIER -92.68 -57.96 2.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.569 -0.707 . . . . 0.0 110.907 179.507 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -77.76 -37.34 49.3 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -179.794 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.59 ' N ' ' O ' ' A' ' 4' ' ' THR . . . -62.56 -52.4 63.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.556 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 31.8 m -59.84 -26.42 65.8 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.06 -1.025 . . . . 0.0 109.267 179.136 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.472 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -89.96 -17.81 27.22 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.441 -0.787 . . . . 0.0 110.69 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -91.2 -39.44 12.1 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.597 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.586 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 2.0 mt -61.96 -49.04 77.69 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.639 -1.164 . . . . 0.0 108.696 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 16' ' ' LEU . . . -65.31 -27.79 68.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 10' ' ' GLN . 26.4 t-20 -61.38 -46.48 90.01 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.586 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 3.9 m-85 -62.71 -21.41 65.76 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 178.159 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.468 ' CB ' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -65.77 -53.76 36.06 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.708 179.336 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -80.24 -24.01 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 109.902 179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -85.63 -62.2 1.58 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.968 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.7 p -51.48 -38.59 54.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.192 -0.943 . . . . 0.0 109.749 179.802 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.488 1.467 0 O-C-N 121.385 -0.822 . . . . 0.0 109.682 179.57 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.576 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.209 -1.036 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 . . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.477 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -33.14 -31.24 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.022 0.439 . . . . 0.0 110.416 -179.441 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.57 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.2 t -62.32 -45.56 92.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.035 -1.041 . . . . 0.0 108.426 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.576 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.0 OUTLIER -67.69 -55.98 11.1 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.71 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -50.85 -57.79 7.59 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.014 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.494 ' O ' ' N ' ' A' ' 13' ' ' ALA . 15.0 m -54.39 -36.45 63.93 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.326 -0.859 . . . . 0.0 109.553 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.483 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 3.3 tp-100 -65.2 -32.05 73.54 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.297 -0.877 . . . . 0.0 110.319 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.55 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 15.0 tpp180 -87.07 -48.0 8.45 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 178.338 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 2.1 mt -52.05 -37.57 54.1 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.011 176.541 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -58.42 -43.94 88.86 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.464 0.649 . . . . 0.0 109.586 179.156 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.458 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 2.3 t30 -49.28 -43.55 43.25 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.251 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.55 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 0.4 OUTLIER -90.2 -19.29 24.37 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.451 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.545 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -67.97 -36.54 80.24 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.345 -0.942 . . . . 0.0 109.45 -179.919 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.7 t -85.17 -34.26 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.366 -0.833 . . . . 0.0 108.849 178.729 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -78.98 -53.75 6.72 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.482 -0.761 . . . . 0.0 110.004 179.539 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 15.5 t -61.98 -39.62 92.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.907 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 12.9 t . . . . . 0 N--CA 1.488 1.454 0 O-C-N 121.298 -0.876 . . . . 0.0 109.293 179.502 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.6 HG23 ' HB3' ' A' ' 7' ' ' CYS . 1.7 t . . . . . 0 C--O 1.207 -1.157 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.467 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -40.06 -17.09 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.799 -0.563 . . . . 0.0 111.597 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.581 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.8 t -77.5 -30.52 53.04 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 120.853 -1.155 . . . . 0.0 108.033 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.6 ' HB3' HG23 ' A' ' 4' ' ' THR . 10.6 p -83.96 -36.3 23.34 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.961 179.249 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.581 -0.699 . . . . 0.0 109.673 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -75.54 -35.74 60.62 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.082 179.13 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.524 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.2 tp60 -81.04 -19.77 43.11 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.38 -0.825 . . . . 0.0 110.955 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.587 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 10.9 tpp180 -87.49 -41.92 13.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 178.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.537 ' N ' HD21 ' A' ' 12' ' ' LEU . 2.2 mm? -56.09 -31.57 63.35 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.396 176.649 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.541 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.07 -33.18 73.14 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.766 0.793 . . . . 0.0 109.097 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.09 -47.45 81.01 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.587 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 2.9 m-85 -70.44 -22.78 62.67 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.465 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.555 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.5 tp -51.16 -34.02 29.54 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 178.922 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . 0.413 ' O ' ' HB3' ' A' ' 20' ' ' SER . 86.2 t -90.97 -55.33 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 119.966 -0.694 . . . . 0.0 110.112 179.002 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.8 m170 -61.3 -39.56 90.91 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.23 -0.919 . . . . 0.0 110.391 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.501 ' N ' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -80.61 -31.39 36.67 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.406 -0.809 . . . . 0.0 108.819 179.249 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.04 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.536 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 2.9 p . . . . . 0 N--CA 1.483 1.212 0 CA-C-O 121.619 0.723 . . . . 0.0 109.228 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.44 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -45.22 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.179 -0.951 . . . . 0.0 110.993 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.536 ' CG2' ' HB ' ' A' ' 4' ' ' THR . 6.0 t -86.06 -28.42 24.12 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.003 -1.061 . . . . 0.0 109.709 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' ALA . 14.8 p -88.67 -36.14 16.39 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.613 -0.68 . . . . 0.0 110.085 -179.455 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -72.85 -61.09 1.93 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.511 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -56.72 -31.99 65.06 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.324 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -76.0 -24.89 55.34 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.784 -1.198 . . . . 0.0 110.591 -179.641 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.6 OUTLIER -91.15 -44.07 9.48 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.641 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -61.96 -43.19 99.35 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.568 178.003 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.35 -29.86 70.14 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.447 -0.783 . . . . 0.0 109.403 179.263 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.83 -44.02 97.69 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.55 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.0 OUTLIER -72.59 -20.84 61.23 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.787 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.577 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -61.76 -39.68 92.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.573 179.489 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -86.1 -44.85 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.787 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -71.66 -51.22 24.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.537 -0.727 . . . . 0.0 110.997 -179.718 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.9 t -67.43 -42.05 83.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.211 -0.931 . . . . 0.0 110.838 -179.411 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.577 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 3.3 m . . . . . 0 C--N 1.301 -1.511 0 O-C-N 120.96 -1.087 . . . . 0.0 109.837 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.55 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.604 0.716 . . . . 0.0 109.792 . . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.86 -22.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.307 -0.871 . . . . 0.0 110.923 179.513 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.54 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -80.44 -38.13 30.68 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.01 -1.056 . . . . 0.0 108.16 179.122 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.55 ' N ' ' O ' ' A' ' 4' ' ' THR . 11.7 p -82.18 -37.31 26.3 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.339 179.436 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.508 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -59.54 -64.32 0.99 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.344 -0.848 . . . . 0.0 108.783 178.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.2 m -53.05 -39.1 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -68.53 -20.72 64.58 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 121.606 -0.683 . . . . 0.0 109.705 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.563 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 5.6 tpm_? -89.76 -49.15 6.8 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 105.769 -1.937 . . . . 0.0 105.769 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.464 HD13 ' N ' ' A' ' 12' ' ' LEU . 8.2 mp -54.79 -35.93 64.37 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.36 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.508 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.95 -27.18 64.53 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.9 t30 -58.75 -45.55 89.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.671 -0.643 . . . . 0.0 109.565 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.563 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 1.5 m-85 -77.64 -17.49 57.7 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.031 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.508 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 tp -66.99 -48.27 68.96 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.433 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.2 t -87.03 -35.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.0 109.983 179.457 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 26.5 m170 -67.48 -49.42 63.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.154 -0.966 . . . . 0.0 110.048 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 8.9 t -73.68 -25.91 60.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -0.872 . . . . 0.0 110.385 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 39.2 t . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.0 110.346 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 121.34 0.591 . . . . 0.0 109.411 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.557 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.28 -27.47 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 CA-C-O 121.108 0.48 . . . . 0.0 110.003 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 2.6 t -62.1 -39.33 92.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.979 . . . . 0.0 108.709 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.9 t -86.49 -48.6 8.25 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.673 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 11' ' ' ARG . . . -57.45 -56.69 18.59 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.547 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.557 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 88.8 m -48.75 -44.21 38.41 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.821 -1.152 . . . . 0.0 108.224 178.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -22.93 67.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.356 -0.84 . . . . 0.0 109.676 178.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 8' ' ' ALA . 0.4 OUTLIER -88.34 -45.08 10.31 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 178.792 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.578 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . 3.8 mm? -56.61 -41.77 77.63 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.578 176.558 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.83 -31.79 72.87 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.15 -44.91 68.15 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.63 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.578 ' CE2' ' HA ' ' A' ' 12' ' ' LEU . 1.1 m-85 -67.1 -24.52 65.94 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.192 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.535 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -67.39 -40.87 85.68 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.176 179.722 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.9 t -77.17 -33.31 20.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 O-C-N 121.352 -0.843 . . . . 0.0 109.394 179.131 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -86.49 -63.53 1.3 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.447 -0.783 . . . . 0.0 110.294 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 t -49.2 -33.5 12.56 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.416 -0.803 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 7.3 t . . . . . 0 C--N 1.303 -1.424 0 O-C-N 121.323 -0.861 . . . . 0.0 108.818 178.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.582 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 2.3 m . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 110.17 -0.307 . . . . 2.5 110.17 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -46.55 -20.35 0.12 Allowed 'General case' 0 C--N 1.296 -1.728 0 O-C-N 120.691 -1.255 . . . . 2.8999999999999999 108.565 178.114 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 4' ' ' THR . 18.9 m -90.92 -83.33 0.27 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.349 -0.844 . . . . 3.3999999999999999 110.322 179.658 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.466 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 1.3 m -60.39 -27.11 67.18 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.311 -0.868 . . . . 2.0 109.986 -179.819 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.582 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -77.54 -47.75 18.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.826 -1.15 . . . . 1.3999999999999999 109.618 179.572 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 30.9 m -66.87 -22.9 65.97 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.626 -1.23 . . . . 1.6000000000000001 108.891 179.017 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.6 mm-40 -86.44 -16.73 36.23 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.361 -0.837 . . . . 1.6000000000000001 109.259 179.024 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.57 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.23 -44.4 9.24 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.037 -1.838 . . . . 1.3 106.037 178.156 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.527 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 11.1 mt -66.27 -37.76 86.23 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.508 -1.224 . . . . 2.1000000000000001 109.188 177.834 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.478 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -70.94 -29.12 65.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 1.5 109.059 178.871 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.6 t-20 -60.66 -45.42 94.21 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 108.525 -0.917 . . . . 2.6000000000000001 108.525 179.027 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.57 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 3.0 m-85 -68.0 -20.49 65.03 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.893 -1.151 . . . . 2.1000000000000001 107.893 178.379 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.538 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.9 tp -60.0 -46.97 87.72 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.8 -0.76 . . . . 2.2999999999999998 109.334 179.302 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.1 -45.71 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.439 -0.788 . . . . 6.2000000000000002 110.454 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 7.2 m170 -64.14 -44.95 90.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.379 -0.825 . . . . 4.2000000000000002 110.766 -179.432 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -78.31 -40.42 36.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.243 -0.91 . . . . 9.0999999999999996 110.64 -179.397 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.9 t . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 10.0 110.588 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.192 0.52 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 56.2 m -86.69 -82.48 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.079 -1.013 . . . . 0.0 109.457 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.522 ' O ' ' OG1' ' A' ' 4' ' ' THR . 0.3 OUTLIER -154.64 17.65 0.46 Allowed 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.417 -0.802 . . . . 0.0 109.426 179.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.606 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 1.3 p 75.88 -86.64 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.567 -0.708 . . . . 0.0 109.425 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.592 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -49.54 -18.5 0.43 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 120.35 -1.469 . . . . 0.0 108.112 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.489 ' N ' ' C ' ' A' ' 4' ' ' THR . 74.8 m -92.44 -71.42 0.65 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.385 -0.822 . . . . 0.0 110.04 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.441 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -61.82 -34.56 76.16 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.553 -0.717 . . . . 0.0 109.225 179.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.606 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -66.79 -56.11 11.9 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.37 -0.932 . . . . 0.0 109.535 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.554 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 42.0 p -55.61 -27.66 50.73 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.036 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -33.0 71.81 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.488 -0.757 . . . . 0.0 110.068 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.485 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 tpp180 -87.38 -44.61 11.24 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.474 ' HB2' ' HA ' ' A' ' 9' ' ' THR . 6.6 mp -54.92 -34.05 62.78 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.598 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.499 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.65 -30.69 68.45 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.764 0.793 . . . . 0.0 109.241 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.13 -40.89 82.43 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.405 -0.81 . . . . 0.0 109.269 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.533 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.4 m-85 -83.64 -16.11 46.39 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 mt -68.39 -49.7 58.2 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.421 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.437 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 22.7 t -76.32 -25.51 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.426 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.505 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 6.0 m170 -89.44 -57.94 2.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.214 -0.929 . . . . 0.0 110.629 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.6 t -54.92 -33.43 62.13 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.416 -0.802 . . . . 0.0 111.852 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -90.73 -34.92 15.18 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.763 -1.211 . . . . 0.0 111.532 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.437 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 57.6 t30 -78.71 -46.29 19.36 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.921 -1.112 . . . . 0.0 111.246 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.522 ' O ' HG12 ' A' ' 26' ' ' ILE . 1.0 OUTLIER -43.9 -24.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.217 -0.927 . . . . 0.0 111.026 -179.099 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.413 ' N ' ' O ' ' A' ' 21' ' ' ASN . 2.1 m-85 -66.29 -53.61 34.62 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.104 -0.998 . . . . 0.0 110.718 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.482 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -59.41 -19.42 47.29 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.302 -1.919 . . . . 0.0 108.302 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 22' ' ' ASN . . . -78.77 -24.54 44.65 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.421 -1.047 . . . . 0.0 111.428 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.638 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.2 mm -90.91 -51.35 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' O ' ' CG2' ' A' ' 30' ' ' THR 0.255 2.6 mm? -49.89 -25.44 3.2 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 176.094 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.482 ' OG ' ' O ' ' A' ' 24' ' ' GLY . 2.2 m -78.39 2.59 18.22 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.242 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.431 ' N ' ' O ' ' A' ' 26' ' ' ILE . 2.5 t -132.82 42.32 3.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.96 -1.088 . . . . 0.0 110.895 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -121.13 -73.97 0.63 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.284 -0.885 . . . . 0.0 109.074 179.424 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.575 ' ND2' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -73.51 -2.23 21.82 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.971 -0.692 . . . . 0.0 109.17 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.6 p -45.26 -20.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.173 -0.954 . . . . 0.0 110.088 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' O ' ' CB ' ' A' ' 34' ' ' SER . . . -115.62 -22.88 4.58 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 33' ' ' GLY . 1.3 m 67.28 -61.16 0.36 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.254 -1.145 . . . . 0.0 109.883 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.471 ' N ' ' O ' ' A' ' 33' ' ' GLY . 2.6 t-20 -67.93 -170.68 0.18 Allowed 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.496 -0.753 . . . . 0.0 109.81 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 m -63.08 102.22 0.35 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.924 . . . . 0.0 110.042 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.072 -0.965 . . . . 0.0 110.3 -179.889 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 12.0 mttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.337 0.589 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.474 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 18.7 m -156.68 -101.56 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -0.906 . . . . 0.0 110.249 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 12.0 t-20 175.5 34.85 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.594 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.7 m -169.48 105.17 0.36 Allowed 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -178.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -34.98 -25.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 120.908 0.385 . . . . 0.0 110.985 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.594 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.0 t -74.0 -40.21 63.09 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 120.946 -1.096 . . . . 0.0 109.479 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' N ' ' O ' ' A' ' 4' ' ' THR . 21.2 t -74.42 -59.77 2.58 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.209 -0.932 . . . . 0.0 109.387 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.89 -46.78 52.09 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.969 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.508 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 6.8 m -57.31 -43.65 83.47 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.165 -0.959 . . . . 0.0 109.184 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.433 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -64.24 -25.38 68.04 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.399 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.11 -43.01 11.37 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -61.38 -30.38 70.5 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.88 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.528 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -68.22 -37.8 81.23 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.755 0.788 . . . . 0.0 109.279 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -41.33 85.42 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.651 -0.656 . . . . 0.0 109.526 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -79.92 -22.05 43.19 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.528 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -60.3 -36.71 78.5 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.164 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.521 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 78.0 t -90.49 -33.36 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.774 . . . . 0.0 109.952 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -80.89 -36.85 30.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.277 -0.89 . . . . 0.0 110.338 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 22.8 t -90.13 -40.45 12.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.118 -0.989 . . . . 0.0 112.302 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.48 ' O ' ' CE1' ' A' ' 23' ' ' PHE . 1.0 OUTLIER -91.2 -20.96 21.39 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.809 -1.182 . . . . 0.0 112.892 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 1.1 t-20 -88.74 -9.42 51.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.571 -1.331 . . . . 0.0 111.653 -178.48 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -57.31 -75.7 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.918 -1.113 . . . . 0.0 110.068 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 20' ' ' SER . 19.6 p90 -54.24 -28.09 39.03 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.092 -1.005 . . . . 0.0 109.024 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.26 -32.43 65.37 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 108.511 -1.836 . . . . 0.0 108.511 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.474 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -66.08 -16.55 64.03 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.419 -1.047 . . . . 0.0 109.448 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.56 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.8 mm -89.29 -49.19 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.464 HD21 ' O ' ' A' ' 23' ' ' PHE 0.255 3.7 mm? -61.66 -16.29 47.47 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.345 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.9 m -67.91 -36.77 80.75 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.288 0.566 . . . . 0.0 110.378 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.578 ' O ' ' CG2' ' A' ' 30' ' ' THR . 0.6 OUTLIER -86.53 -58.07 2.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.304 -0.873 . . . . 0.0 110.494 -179.725 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.578 ' CG2' ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 81.59 -35.13 0.1 Allowed 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 121.153 0.502 . . . . 0.0 110.855 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.563 ' N ' HG23 ' A' ' 30' ' ' THR . 0.1 OUTLIER -66.45 -7.06 17.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.164 -0.96 . . . . 0.0 109.68 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.413 ' O ' HG12 ' A' ' 32' ' ' VAL . 3.6 t -124.31 -15.35 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.479 -0.763 . . . . 0.0 110.335 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.42 59.49 0.42 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 30' ' ' THR . 67.4 p -121.01 -86.59 0.65 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -1.137 . . . . 0.0 109.925 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.449 ' O ' ' OG1' ' A' ' 36' ' ' THR . 10.0 m-80 -149.45 129.55 13.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.285 -0.885 . . . . 0.0 110.151 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 35' ' ' ASN . 10.4 p 43.15 77.18 0.07 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.398 -0.814 . . . . 0.0 110.266 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 p90 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.294 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.467 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 3.0 mtmp? . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.119 0.485 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.467 ' SG ' ' O ' ' A' ' 1' ' ' LYS . 35.5 m -155.96 96.83 1.76 Allowed 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.44 -0.788 . . . . 0.0 109.432 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.501 ' O ' ' OG1' ' A' ' 4' ' ' THR . 48.5 t30 -89.35 27.07 1.51 Allowed 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.388 -0.82 . . . . 0.0 109.119 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.614 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 3.2 p 63.01 -71.0 0.06 Allowed 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.971 -0.455 . . . . 0.0 109.935 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.521 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -46.12 -24.8 0.49 Allowed 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 118.299 -1.36 . . . . 0.0 107.918 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.47 ' N ' ' C ' ' A' ' 4' ' ' THR . 4.3 m -92.71 -76.79 0.46 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.581 -0.699 . . . . 0.0 109.812 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.9 m -60.16 -40.47 89.99 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.571 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.614 ' HB3' ' HA ' ' A' ' 4' ' ' THR . . . -64.61 -48.72 73.86 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 118.886 -1.126 . . . . 0.0 108.919 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.3 m -51.15 -41.85 60.39 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 118.432 -1.307 . . . . 0.0 108.049 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.454 ' O ' ' HB2' ' A' ' 14' ' ' ASN . 3.6 tp60 -65.52 -21.68 66.64 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 121.446 -0.784 . . . . 0.0 110.661 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.588 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.08 -50.87 5.61 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 179.201 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -42.18 98.54 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.762 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -68.77 -27.52 65.97 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.484 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.7 t30 -55.9 -41.11 74.01 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.588 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 2.2 m-85 -88.96 -16.92 30.58 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.499 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 tp -72.38 -41.42 66.35 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.354 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 92.4 t -86.17 -27.48 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.858 . . . . 0.0 109.738 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 12.7 m170 -84.06 -49.49 8.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.278 -0.889 . . . . 0.0 109.928 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 p -71.01 -24.54 62.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.302 -0.874 . . . . 0.0 110.645 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 11.3 t -90.5 -47.67 7.57 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.106 -0.996 . . . . 0.0 110.394 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 59.5 t-20 -56.88 -30.9 64.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.065 -1.022 . . . . 0.0 110.045 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.466 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -73.08 -43.03 62.39 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -0.903 . . . . 0.0 109.91 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.563 ' CD1' ' C ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -52.17 -40.0 60.86 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.22 -0.925 . . . . 0.0 108.545 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.56 96.58 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.599 -1.801 . . . . 0.0 108.599 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -63.53 -13.3 39.92 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.456 -1.026 . . . . 0.0 109.9 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.498 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.0 mm -91.31 -45.22 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' O ' ' N ' ' A' ' 31' ' ' ASN . 6.8 mp -47.29 -26.23 1.18 Allowed 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 176.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.495 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.6 m -61.11 -19.45 61.5 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.069 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 m -100.05 -31.78 11.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.424 -0.798 . . . . 0.0 110.736 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.534 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 7.5 p -136.01 -16.55 1.68 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.832 -1.168 . . . . 0.0 111.192 -178.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.549 ' O ' ' CG2' ' A' ' 32' ' ' VAL . 0.6 OUTLIER 41.96 27.79 0.08 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.667 0.746 . . . . 0.0 109.189 -179.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.549 ' CG2' ' O ' ' A' ' 31' ' ' ASN . 1.4 t -174.31 -54.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.869 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -37.15 -39.75 0.49 Allowed Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -132.81 143.96 49.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.06 -1.259 . . . . 0.0 110.506 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.402 ' HB2' HD12 ' A' ' 27' ' ' LEU . 9.3 m120 47.63 74.89 0.15 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -0.903 . . . . 0.0 110.326 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.443 ' CG2' ' O ' ' A' ' 36' ' ' THR . 13.3 t -120.67 63.3 0.86 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.427 ' CD1' ' C ' ' A' ' 37' ' ' TYR . 29.2 p90 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.212 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.226 0.536 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 36.3 t -52.01 -73.25 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.246 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER 178.53 -34.8 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.534 ' O ' ' N ' ' A' ' 7' ' ' CYS . 75.9 p -125.34 124.28 41.21 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.465 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -42.23 -22.49 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.494 -0.754 . . . . 0.0 109.86 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.52 ' N ' ' O ' ' A' ' 4' ' ' THR . 1.8 t -77.79 -29.3 50.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.0 109.884 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.9 t -89.31 -63.69 1.25 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.189 -0.944 . . . . 0.0 109.634 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.477 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -44.58 -51.49 8.94 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.355 -0.841 . . . . 0.0 108.995 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.465 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 99.0 m -57.65 -48.06 80.52 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.199 -0.938 . . . . 0.0 109.342 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.77 -17.41 64.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.243 -0.911 . . . . 0.0 110.63 179.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.468 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 3.2 ttm180 -91.19 -43.24 9.97 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.477 HD23 ' O ' ' A' ' 8' ' ' ALA . 3.9 mm? -66.2 -37.08 84.74 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.189 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.487 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.26 -29.54 66.35 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.541 -0.724 . . . . 0.0 109.192 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.477 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -60.78 -43.83 97.57 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.918 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.608 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.97 -23.56 31.0 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.487 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -58.71 -58.33 9.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.396 -0.815 . . . . 0.0 109.862 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.1 -32.53 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.373 -0.83 . . . . 0.0 110.299 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' A' ' 22' ' ' ASN . 5.8 m170 -81.47 -68.16 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.19 -0.944 . . . . 0.0 110.288 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 8.5 t -39.32 -40.17 0.75 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.004 -0.678 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 1.2 t -65.77 -62.12 1.69 Allowed 'General case' 0 C--N 1.297 -1.707 0 O-C-N 120.951 -1.093 . . . . 0.0 109.969 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' O ' ' CB ' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -92.47 22.9 4.28 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.329 -0.857 . . . . 0.0 110.543 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 18' ' ' HIS . 11.2 t-20 -92.36 -63.82 1.19 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.041 -1.037 . . . . 0.0 111.049 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.615 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 7.1 p90 -41.74 -33.77 0.54 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.871 0.844 . . . . 0.0 109.29 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.615 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.03 -26.64 23.55 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.624 -1.391 . . . . 0.0 109.624 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.521 ' CB ' ' O ' ' A' ' 21' ' ' ASN . . . -76.68 -21.06 55.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -1.163 . . . . 0.0 110.684 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.59 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.5 mm -90.95 -45.03 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.27 -19.8 37.28 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' OG ' ' A' ' 29' ' ' SER . 4.2 m -78.37 -5.56 52.63 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.001 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 28' ' ' SER . 50.7 m -165.08 63.66 0.12 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 0.0 109.797 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.5 ' O ' ' HB2' ' A' ' 31' ' ' ASN . 5.4 t -125.17 -44.88 1.87 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 121.582 0.706 . . . . 0.0 110.217 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.505 ' O ' ' CB ' ' A' ' 32' ' ' VAL . 1.7 t-20 168.66 -21.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.87 -0.519 . . . . 0.0 110.55 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.505 ' CB ' ' O ' ' A' ' 31' ' ' ASN . 2.8 t 70.68 13.38 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.191 -0.943 . . . . 0.0 110.155 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 31' ' ' ASN . . . -135.15 -107.8 0.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.1 m -114.92 -26.92 7.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.275 -1.132 . . . . 0.0 110.065 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.437 ' O ' ' C ' ' A' ' 36' ' ' THR . 11.3 t30 55.36 -163.89 0.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.351 -0.843 . . . . 0.0 110.697 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 35' ' ' ASN . 17.7 p -37.79 98.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.708 -0.62 . . . . 0.0 110.947 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 35' ' ' ASN . 10.2 p90 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.087 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.209 0.528 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 22.8 m -112.89 -116.56 0.32 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.22 -0.925 . . . . 0.0 109.798 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' A' ' 4' ' ' THR . 11.6 t-20 -162.44 17.64 0.09 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.145 -0.972 . . . . 0.0 110.147 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.643 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 0.7 OUTLIER 72.88 -83.51 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 O-C-N 120.946 -1.096 . . . . 0.0 109.911 -179.714 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -44.93 -22.05 0.08 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.534 -1.354 . . . . 0.0 108.748 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.523 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -91.4 -75.29 0.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.328 -0.858 . . . . 0.0 110.941 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 0.8 OUTLIER -63.19 -25.9 68.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.912 -1.117 . . . . 0.0 109.49 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.643 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -70.65 -56.99 5.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.741 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 44.5 p -56.58 -28.27 59.87 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.386 -1.326 . . . . 0.0 107.902 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 4.5 mm100 -78.28 -22.15 48.68 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.553 0.692 . . . . 0.0 109.616 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.07 -42.04 13.37 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.559 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 3.7 mm? -57.3 -45.05 84.52 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.55 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.9 -22.28 65.09 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -63.88 -45.31 89.97 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.559 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 9.0 m-85 -65.94 -23.41 66.6 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -55.35 -40.27 71.06 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.9 t -85.65 -44.97 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 120.109 -0.637 . . . . 0.0 109.955 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.468 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 21.9 m-70 -66.84 -50.03 63.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.217 -0.927 . . . . 0.0 109.693 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.2 t -55.51 -53.34 57.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 0.0 109.711 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 t -61.02 -18.83 59.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.374 -0.828 . . . . 0.0 109.9 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.468 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 53.1 t30 -74.19 -49.91 21.46 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.219 -0.925 . . . . 0.0 110.036 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.401 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 5.1 t-20 -65.22 -53.09 49.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.438 -0.789 . . . . 0.0 109.784 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.494 ' CZ ' ' CD2' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -52.4 -35.46 51.78 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.395 -0.815 . . . . 0.0 109.002 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.2 -17.94 75.44 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -74.32 -19.51 60.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.38 -1.071 . . . . 0.0 109.902 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.559 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.8 mm -91.36 -51.71 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' CD2' ' CZ ' ' A' ' 23' ' ' PHE . 3.8 mp -51.61 -23.82 4.74 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.463 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.3 m -59.41 -13.11 7.3 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.539 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.587 ' O ' HG21 ' A' ' 30' ' ' THR . 0.3 OUTLIER -91.69 -59.66 2.07 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.127 -0.983 . . . . 0.0 109.444 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.587 HG21 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 64.58 -48.51 0.32 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.457 -0.777 . . . . 0.0 111.216 179.423 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.527 ' N ' HG23 ' A' ' 30' ' ' THR . 0.2 OUTLIER -83.09 12.15 5.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.146 -0.971 . . . . 0.0 110.035 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.7 p -70.84 -3.1 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.212 -0.93 . . . . 0.0 110.316 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.88 51.54 0.11 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -158.11 -83.21 0.05 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.34 -1.094 . . . . 0.0 110.47 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' THR . 71.3 m-80 -84.45 161.65 20.23 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.4 -0.812 . . . . 0.0 110.414 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 35' ' ' ASN . 27.1 p 44.56 96.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.231 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.151 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.232 0.539 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.545 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 1.0 OUTLIER -69.91 -85.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.274 -0.891 . . . . 0.0 110.591 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 13.8 t-20 170.08 -26.75 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.532 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.0 OUTLIER -132.78 124.91 28.97 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -40.41 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.651 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.532 ' N ' ' O ' ' A' ' 4' ' ' THR . 4.7 t -67.36 -39.13 85.68 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 108.782 178.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.6 t -79.25 -47.61 15.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.25 77.37 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 18.7 m -56.14 -39.61 72.53 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.509 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -69.1 -19.25 64.05 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.65 0.738 . . . . 0.0 109.418 178.735 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 1.7 mmm180 -87.61 -51.28 5.98 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 105.264 -2.124 . . . . 0.0 105.264 177.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.48 ' O ' HD12 ' A' ' 16' ' ' LEU . 10.6 mt -56.08 -29.94 61.29 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.78 -26.1 62.29 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 30.6 t-20 -58.94 -46.76 87.19 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CB ' ' A' ' 19' ' ' SER . 2.1 m-85 -76.94 -21.18 55.19 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 mp -67.33 -67.58 0.44 Allowed 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.176 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.538 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 71.8 t -58.63 -26.31 30.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 110.445 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.495 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 31.3 m-70 -88.56 -52.8 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.187 -0.946 . . . . 0.0 111.298 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.0 p -68.81 -32.62 72.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.281 -0.887 . . . . 0.0 110.145 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.525 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 59.7 m -74.47 -40.26 61.99 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.997 -1.065 . . . . 0.0 109.1 179.091 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.538 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -45.04 -36.51 3.55 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.111 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.485 ' O ' HG12 ' A' ' 26' ' ' ILE . 8.8 t30 -62.52 -62.05 2.01 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.995 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.04 -26.39 10.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.468 -0.77 . . . . 0.0 109.515 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.03 -37.99 36.55 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -67.11 -9.92 44.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.266 -1.138 . . . . 0.0 109.918 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.532 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.2 mm -91.25 -44.96 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.519 ' O ' ' CG2' ' A' ' 30' ' ' THR . 11.8 mt -49.24 -27.23 3.54 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.5 m -58.39 -34.6 70.91 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.825 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.89 11.82 13.6 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.576 -0.703 . . . . 0.0 110.102 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.548 ' CG2' ' H ' ' A' ' 31' ' ' ASN . 2.5 t -45.32 -54.98 6.43 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.084 0.945 . . . . 0.0 109.632 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.548 ' H ' ' CG2' ' A' ' 30' ' ' THR . 14.1 p30 -148.97 13.68 0.89 Allowed 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.542 HG22 ' O ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER 56.97 39.1 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 121.771 0.796 . . . . 0.0 110.371 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' N ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.01 -80.57 0.11 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.901 -0.879 . . . . 0.0 110.901 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 t -82.51 171.23 14.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.193 -1.181 . . . . 0.0 111.774 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 37' ' ' TYR . 10.7 t30 61.9 157.61 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.609 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.591 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 4.0 t -61.1 79.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.433 -0.792 . . . . 0.0 109.201 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.598 ' OXT' ' CD2' ' A' ' 37' ' ' TYR . 3.1 p90 . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.982 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.174 0.511 . . . . 0.0 110.076 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.502 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 52.6 t -179.49 -76.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 110.243 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.502 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.2 t-20 177.03 -33.57 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.917 0.865 . . . . 0.0 108.799 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.525 ' O ' ' N ' ' A' ' 6' ' ' THR . 14.7 p -132.37 122.94 25.83 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.499 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -39.88 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.679 -0.638 . . . . 0.0 109.555 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.527 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 6.1 t -64.37 -42.45 96.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' CG2' ' A' ' 6' ' ' THR . 5.3 t -84.12 -42.99 15.46 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.46 ' O ' HD21 ' A' ' 12' ' ' LEU . . . -60.82 -53.38 58.06 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.499 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 85.3 m -55.55 -38.59 69.5 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.875 -1.13 . . . . 0.0 108.147 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -71.13 -21.26 62.22 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.846 0.832 . . . . 0.0 109.394 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -87.01 -43.03 12.65 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.513 ' N ' HD21 ' A' ' 12' ' ' LEU . 2.3 mm? -57.57 -39.57 77.03 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.791 176.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.499 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.82 -28.34 67.48 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.63 -43.32 97.65 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.507 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -75.81 -17.85 59.7 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.045 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.543 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.7 OUTLIER -67.11 -38.66 86.01 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.591 -0.844 . . . . 0.0 108.978 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.47 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 46.7 t -86.41 -29.2 5.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.592 -0.692 . . . . 0.0 109.335 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -85.1 -51.56 6.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.369 -0.832 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.3 p -68.81 -39.92 79.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.812 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.587 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 7.8 t -69.1 -52.62 26.43 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.192 -0.943 . . . . 0.0 110.037 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.47 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 24.7 t-20 -45.08 -31.25 1.31 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.638 -0.664 . . . . 0.0 110.917 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.428 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -43.78 -45.39 7.24 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.033 -1.042 . . . . 0.0 110.244 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.587 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -57.77 -14.44 5.82 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.449 -0.782 . . . . 0.0 110.159 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.57 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.51 -28.33 17.1 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.44 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -65.74 -25.22 67.19 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.41 -1.053 . . . . 0.0 109.752 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.591 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.7 mm -90.76 -46.69 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 23' ' ' PHE . 4.2 mm? -61.44 -17.45 54.44 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.506 ' O ' HG23 ' A' ' 32' ' ' VAL . 1.4 m -69.46 -0.38 6.44 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.15 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.79 5.04 32.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.686 -1.259 . . . . 0.0 110.705 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.511 ' CG2' ' H ' ' A' ' 31' ' ' ASN . 4.6 t -58.11 -47.88 81.89 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-O 122.227 1.013 . . . . 0.0 109.045 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.511 ' H ' ' CG2' ' A' ' 30' ' ' THR . 0.8 OUTLIER 176.3 27.33 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 115.441 -0.799 . . . . 0.0 108.955 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.516 ' O ' ' N ' ' A' ' 34' ' ' SER . 32.6 m -123.13 43.83 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.378 -0.826 . . . . 0.0 109.042 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -38.24 -28.35 0.05 OUTLIER Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.516 ' N ' ' O ' ' A' ' 32' ' ' VAL . 1.9 t 67.47 22.08 9.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.234 -1.157 . . . . 0.0 109.658 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.445 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.7 t30 -88.1 166.03 14.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.518 -0.739 . . . . 0.0 109.945 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' ASN . 6.2 m 54.69 105.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.357 -0.839 . . . . 0.0 110.042 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 p90 . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.22 -179.831 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 11.8 mttt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.296 0.57 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 41.9 t -45.66 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.388 -0.82 . . . . 0.0 110.05 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.0 t-20 178.52 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.544 ' HB ' HG22 ' A' ' 6' ' ' THR . 3.0 m -121.51 121.53 37.71 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.504 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.53 -24.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.264 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.544 HG22 ' HB ' ' A' ' 4' ' ' THR . 14.9 t -74.61 -40.77 61.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.211 -0.931 . . . . 0.0 109.372 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' N ' ' O ' ' A' ' 4' ' ' THR . 9.4 t -77.31 -57.79 3.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.423 -0.798 . . . . 0.0 109.829 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.482 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.83 -46.27 51.0 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.385 -0.822 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.504 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 22.1 m -64.77 -44.16 90.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.818 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -78.15 -10.95 59.87 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.362 -0.836 . . . . 0.0 111.122 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.6 OUTLIER -91.38 -51.72 5.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 7.5 mt -58.51 -45.22 89.24 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.869 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.447 ' HB1' ' O ' ' A' ' 9' ' ' THR . . . -64.52 -27.4 68.94 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 20.1 t-20 -53.36 -46.92 69.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -90.68 -20.14 22.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.535 -0.728 . . . . 0.0 109.07 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.476 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -70.68 -40.4 72.95 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.507 -0.877 . . . . 0.0 109.629 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.475 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 33.1 t -84.64 -29.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.303 -0.873 . . . . 0.0 109.619 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.495 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 9.9 m170 -85.86 -47.52 9.61 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.465 -0.772 . . . . 0.0 110.924 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -78.22 -22.95 47.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.244 -0.91 . . . . 0.0 111.692 -178.555 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 4.2 p -91.12 -40.43 11.6 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.592 -1.318 . . . . 0.0 111.423 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.552 ' O ' ' CB ' ' A' ' 25' ' ' ALA . 8.2 t30 -90.69 -42.47 10.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.044 -1.035 . . . . 0.0 111.669 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.52 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -85.39 -45.41 11.91 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 120.813 -1.179 . . . . 0.0 111.513 -178.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.565 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 4.2 t80 -77.52 -40.12 43.78 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.108 -0.995 . . . . 0.0 111.339 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.407 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -90.86 -40.88 5.48 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.614 -1.279 . . . . 0.0 111.625 -178.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.552 ' CB ' ' O ' ' A' ' 21' ' ' ASN . . . -75.55 -24.5 56.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.613 -1.521 . . . . 0.0 111.668 -178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.524 ' O ' ' N ' ' A' ' 29' ' ' SER . 3.7 mm -92.28 -42.53 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.63 -1.294 . . . . 0.0 108.594 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 23' ' ' PHE 0.262 3.0 mm? -50.42 -27.39 6.33 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.462 ' O ' ' OG ' ' A' ' 29' ' ' SER . 50.2 m -78.05 -22.54 48.97 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.623 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 26' ' ' ILE . 74.6 m -167.62 66.72 0.08 Allowed 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.343 -0.848 . . . . 0.0 109.672 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.424 HG23 ' HB2' ' A' ' 34' ' ' SER . 4.8 t -59.44 -30.0 68.18 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.012 -1.106 . . . . 0.0 108.012 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.566 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -164.54 -30.19 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.757 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.566 ' CG1' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER 178.57 39.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.342 -0.849 . . . . 0.0 109.855 178.583 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.467 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . 102.21 -44.99 1.42 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 33' ' ' GLY . 5.6 t 56.34 45.13 23.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.112 -1.228 . . . . 0.0 110.203 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.458 ' O ' ' OG1' ' A' ' 36' ' ' THR . 25.3 t30 -84.89 138.26 32.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.318 -0.863 . . . . 0.0 110.061 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 35' ' ' ASN . 46.5 p 44.53 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.168 -0.957 . . . . 0.0 110.067 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.29 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.5 tttm . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.211 0.529 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 83.1 m -115.06 -116.2 0.33 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 0.0 109.494 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.54 ' O ' ' CB ' ' A' ' 4' ' ' THR . 8.5 t30 -148.8 10.85 0.83 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.279 -0.888 . . . . 0.0 109.607 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.605 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 1.5 m 77.57 -82.06 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.159 0 O-C-N 121.471 -0.768 . . . . 0.0 110.468 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.542 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . -43.86 -21.92 0.05 OUTLIER 'General case' 0 C--N 1.295 -1.796 0 O-C-N 120.818 -1.176 . . . . 0.0 109.542 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.7 p -91.47 -85.84 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.134 -0.979 . . . . 0.0 110.595 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.411 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 2.1 m -55.82 -30.45 61.42 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.538 -0.726 . . . . 0.0 109.625 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.605 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -74.63 -58.9 2.99 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.114 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.565 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.5 t -50.67 -27.15 6.42 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 118.347 -1.341 . . . . 0.0 109.623 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -35.71 72.78 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.581 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 14.4 ttp180 -88.21 -39.73 14.25 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.53 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.1 mm? -64.24 -25.99 68.31 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.077 176.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.56 -43.18 81.28 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 121.725 0.774 . . . . 0.0 109.719 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.546 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 40.7 t30 -56.32 -42.66 78.01 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.561 0.696 . . . . 0.0 109.639 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -86.65 -12.98 46.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -69.5 -40.4 77.02 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.284 -0.966 . . . . 0.0 108.967 179.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.469 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 46.3 t -80.73 -33.06 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.297 -0.877 . . . . 0.0 109.256 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -81.97 -48.78 11.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.462 -0.774 . . . . 0.0 110.495 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.6 t -70.75 -50.4 36.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.212 -0.93 . . . . 0.0 110.794 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 3.4 t -61.39 -38.67 87.9 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.329 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.469 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 26.2 t30 -64.06 -10.4 21.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.298 -0.876 . . . . 0.0 109.95 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 26' ' ' ILE . 1.9 t-20 -47.6 -77.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.259 -0.901 . . . . 0.0 110.209 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.499 ' CE2' ' O ' ' A' ' 20' ' ' SER . 18.4 p90 -56.24 -24.4 42.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.394 -0.816 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.94 -38.06 64.77 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.474 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -71.37 -21.45 62.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -1.151 . . . . 0.0 110.422 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.572 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.4 mm -91.92 -42.71 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.534 ' N ' HD21 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -48.14 -27.06 2.15 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 176.553 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.4 m -62.03 -12.66 19.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.05 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.474 ' C ' HG23 ' A' ' 30' ' ' THR . 23.1 m -152.99 54.41 0.77 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.234 -0.916 . . . . 0.0 110.632 -179.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.474 HG23 ' C ' ' A' ' 29' ' ' SER . 72.7 p -133.23 -43.81 0.85 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.255 -0.903 . . . . 0.0 110.651 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.43 -25.94 0.75 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.338 -0.851 . . . . 0.0 109.465 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -33.9 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 CA-C-O 121.449 0.643 . . . . 0.0 109.504 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 30' ' ' THR . . . 133.36 102.08 0.78 Allowed Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.3 t -116.19 31.77 6.52 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.259 -1.142 . . . . 0.0 109.988 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -103.4 55.58 0.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.288 -0.883 . . . . 0.0 110.264 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.548 ' C ' ' CD2' ' A' ' 37' ' ' TYR . 41.0 p -108.84 71.77 0.79 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.285 -0.884 . . . . 0.0 110.487 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.548 ' CD2' ' C ' ' A' ' 36' ' ' THR . 39.2 p90 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.539 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.8 mtmm . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.17 0.51 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 26.9 t -98.53 -108.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.179 -0.95 . . . . 0.0 110.099 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.5 t30 169.6 -21.29 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.044 -1.035 . . . . 0.0 109.695 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.555 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -113.21 108.57 17.46 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.249 -0.907 . . . . 0.0 109.813 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -38.73 -28.98 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.51 0.672 . . . . 0.0 109.689 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.551 HG23 ' CG2' ' A' ' 4' ' ' THR . 9.4 t -67.01 -44.91 79.1 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.2 OUTLIER -72.25 -39.08 68.71 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.097 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.474 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -62.45 -53.51 53.73 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.494 ' O ' ' N ' ' A' ' 13' ' ' ALA . 18.2 m -57.39 -33.81 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.518 ' NE2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.8 -27.73 66.13 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.47 -0.769 . . . . 0.0 109.803 179.273 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -87.56 -47.12 8.96 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -58.99 -22.57 60.76 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.146 176.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.579 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.53 -37.71 65.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.885 0.85 . . . . 0.0 109.287 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -57.82 -42.5 84.43 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.582 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -81.64 -17.22 48.88 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.804 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.579 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 5.6 mt -66.04 -61.04 2.26 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.85 -1.14 . . . . 0.0 108.508 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -56.34 -41.98 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.773 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -72.84 -56.67 4.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.39 -0.819 . . . . 0.0 110.528 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.571 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.4 t -65.6 -50.52 64.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.291 -0.88 . . . . 0.0 110.618 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 70.7 m -44.31 -44.61 8.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.097 -1.002 . . . . 0.0 109.428 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -51.01 -41.74 59.97 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.454 -0.899 . . . . 0.0 109.001 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.437 ' O ' ' N ' ' A' ' 25' ' ' ALA . 1.3 t30 -73.27 -54.66 7.84 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.566 ' CZ ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -51.78 -30.35 22.59 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.401 ' HA2' ' HB2' ' A' ' 27' ' ' LEU . . . -77.01 -28.17 59.07 Favored Glycine 0 N--CA 1.486 2.029 0 N-CA-C 108.309 -1.916 . . . . 0.0 108.309 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -65.0 -18.41 65.27 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.442 -1.034 . . . . 0.0 108.998 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.573 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.0 mm -91.57 -39.57 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.566 HD23 ' CZ ' ' A' ' 23' ' ' PHE . 3.6 mp -63.38 -13.49 40.04 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 176.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.8 m -75.44 -1.93 26.36 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 121.793 -0.567 . . . . 0.0 109.916 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 m -143.61 8.49 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.211 -0.93 . . . . 0.0 110.878 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.488 HG21 ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -55.74 -78.41 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.21 -0.931 . . . . 0.0 109.653 179.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.498 ' O ' ' HB ' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -136.7 8.95 3.08 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.446 -0.784 . . . . 0.0 109.102 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.498 ' HB ' ' O ' ' A' ' 31' ' ' ASN . 10.8 t 65.82 5.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 O-C-N 121.522 -0.736 . . . . 0.0 110.745 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 165.61 -92.98 0.11 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -170.9 40.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -1.096 . . . . 0.0 110.093 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.445 ' O ' ' O ' ' A' ' 34' ' ' SER . 54.4 t30 57.3 111.06 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.358 -0.839 . . . . 0.0 110.248 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 35.1 m -62.66 93.29 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.192 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.0 p90 . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.142 -179.837 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.423 ' HB3' ' NZ ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.167 0.508 . . . . 0.0 110.239 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 3.3 m -93.61 -65.24 1.01 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.24 -0.913 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 9.6 t30 175.5 -32.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.53 ' O ' ' N ' ' A' ' 7' ' ' CYS . 3.1 m -99.23 115.13 28.41 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.57 -27.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.337 0.589 . . . . 0.0 109.816 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.555 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 5.2 t -67.72 -45.08 76.09 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.219 -0.925 . . . . 0.0 108.619 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' CG2' ' A' ' 6' ' ' THR . 38.9 t -76.53 -49.97 15.11 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.318 -0.864 . . . . 0.0 108.733 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.444 ' O ' HD11 ' A' ' 12' ' ' LEU . . . -51.62 -51.07 58.6 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.478 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.7 m -59.71 -45.97 90.51 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.426 -0.796 . . . . 0.0 108.952 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.541 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -69.63 -13.17 62.17 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.155 -0.966 . . . . 0.0 109.96 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -91.1 -52.85 4.63 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.444 HD11 ' O ' ' A' ' 8' ' ' ALA . 4.1 mp -52.0 -42.43 63.0 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.47 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.61 -31.17 72.25 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.19 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 3.7 t-20 -53.26 -52.67 58.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.426 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 2.6 m-85 -60.92 -22.03 63.97 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.25 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.553 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.6 tp -75.77 -38.66 58.15 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.696 0.76 . . . . 0.0 109.149 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.529 ' O ' ' ND2' ' A' ' 21' ' ' ASN . 17.7 t -88.32 -36.35 9.11 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.235 -0.915 . . . . 0.0 109.366 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.46 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.4 m-70 -74.65 -52.85 10.57 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.13 -0.981 . . . . 0.0 111.153 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.93 -31.37 15.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.245 -0.909 . . . . 0.0 112.273 -178.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER -91.05 -27.21 18.76 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.746 -1.221 . . . . 0.0 112.648 -178.043 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -77.75 -12.72 60.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.337 -1.477 . . . . 0.0 110.492 -179.462 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -42.31 -66.41 0.36 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.923 -1.11 . . . . 0.0 110.365 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.566 ' CE2' ' O ' ' A' ' 20' ' ' SER . 6.7 p90 -60.32 -31.35 70.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.265 -0.897 . . . . 0.0 110.363 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.555 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -77.93 -20.59 73.03 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.522 ' N ' ' O ' ' A' ' 21' ' ' ASN . . . -78.75 -19.97 51.04 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.295 -1.121 . . . . 0.0 109.937 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.582 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.0 mm -90.49 -47.1 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.474 HD21 ' O ' ' A' ' 23' ' ' PHE . 3.4 mm? -51.42 -25.46 6.3 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.433 ' N ' ' C ' ' A' ' 26' ' ' ILE . 8.8 m -76.52 5.22 7.68 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.458 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.487 ' N ' ' O ' ' A' ' 26' ' ' ILE . 1.3 m -178.29 52.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.059 -1.025 . . . . 0.0 110.438 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 0.3 OUTLIER -93.83 -73.31 0.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.175 -0.953 . . . . 0.0 108.615 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.521 ' N ' ' OG1' ' A' ' 30' ' ' THR . 30.2 p30 -122.92 -4.61 8.56 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.568 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.3 OUTLIER 55.15 36.57 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.716 -0.615 . . . . 0.0 109.872 -179.791 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.544 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -21.26 -50.72 0.01 OUTLIER Glycine 0 N--CA 1.502 3.055 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.503 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -67.05 79.09 0.13 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -1.195 . . . . 0.0 109.67 179.359 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.479 ' HB3' HG12 ' A' ' 32' ' ' VAL . 9.0 p30 -153.52 176.06 12.48 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.0 110.454 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.411 ' O ' ' C ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -49.7 103.73 0.05 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.313 -0.867 . . . . 0.0 109.946 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 1.1 p90 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.31 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.455 ' O ' ' HE3' ' A' ' 1' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.461 0.648 . . . . 0.0 110.355 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.526 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -132.09 -74.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.853 . . . . 0.0 109.375 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 6.4 t30 162.25 -25.47 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.564 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -166.95 139.88 3.6 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -41.61 -23.32 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.541 ' N ' ' O ' ' A' ' 4' ' ' THR . 4.5 t -72.32 -39.88 67.87 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 4' ' ' THR . 43.6 t -70.03 -40.26 75.29 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.75 -48.41 63.8 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.519 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 5.5 m -57.71 -32.63 67.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.457 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 4.9 tt0 -69.26 -25.19 64.14 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.74 0.781 . . . . 0.0 109.687 179.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -88.64 -53.55 4.58 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.288 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.487 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -50.3 -37.83 38.37 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 175.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.72 -31.45 72.62 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -50.98 -44.55 60.81 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.2 m-85 -91.59 -26.79 18.55 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.543 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.75 -43.87 67.93 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 118.619 -1.232 . . . . 0.0 108.693 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.5 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 23.9 t -73.51 -31.64 33.56 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.256 178.702 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -85.18 -36.56 20.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.416 -0.803 . . . . 0.0 110.693 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.5 t -89.4 -20.36 24.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.182 -0.949 . . . . 0.0 111.416 -178.749 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 20.2 m -89.75 -46.43 8.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.758 -1.214 . . . . 0.0 110.641 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 2.9 m-80 -56.06 -16.32 4.85 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 109.762 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.504 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -37.07 -46.62 0.68 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.582 -0.699 . . . . 0.0 110.795 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 26' ' ' ILE . 15.8 m-85 -63.79 -45.92 87.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.14 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.462 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -47.63 -26.88 4.13 Favored Glycine 0 N--CA 1.485 1.963 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -84.13 -24.08 30.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.716 -0.873 . . . . 0.0 110.153 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.534 ' N ' HD13 ' A' ' 26' ' ' ILE . 5.6 mm -91.83 -53.83 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.495 ' N ' HD21 ' A' ' 27' ' ' LEU . 4.0 mm? -49.78 -30.24 9.23 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 176.298 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -47.53 -35.77 9.43 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.131 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.542 ' O ' ' HB ' ' A' ' 30' ' ' THR . 39.3 m -112.58 -67.99 0.96 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.542 ' HB ' ' O ' ' A' ' 29' ' ' SER . 0.8 OUTLIER 159.9 -57.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.89 0.852 . . . . 0.0 109.859 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.477 ' H ' ' CG2' ' A' ' 30' ' ' THR . 10.3 p30 -153.61 -1.48 0.21 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.902 -0.499 . . . . 0.0 111.243 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.424 ' CG1' ' N ' ' A' ' 33' ' ' GLY . 7.8 p -175.21 -45.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.707 -1.245 . . . . 0.0 110.586 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.424 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . 106.3 -56.94 0.49 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.416 -1.473 . . . . 0.0 109.416 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.2 p -144.96 -95.88 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.266 -1.138 . . . . 0.0 110.39 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -124.23 179.14 5.01 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.079 -1.013 . . . . 0.0 110.099 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 36' ' ' THR . 13.1 t -44.85 105.81 0.06 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.099 -1.001 . . . . 0.0 110.087 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' C ' ' A' ' 37' ' ' TYR . 18.3 p90 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.305 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.148 0.499 . . . . 0.0 109.971 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 7.6 t -44.79 -68.43 0.2 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.263 -0.898 . . . . 0.0 110.431 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.4 t-20 171.1 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.481 -0.762 . . . . 0.0 108.968 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.545 ' CG2' HG23 ' A' ' 6' ' ' THR . 2.5 m -136.97 120.38 16.98 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.661 -0.649 . . . . 0.0 109.348 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -39.69 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.545 HG23 ' CG2' ' A' ' 4' ' ' THR . 8.9 t -73.76 -40.27 63.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.519 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.536 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.0 t -72.31 -54.42 9.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.608 -0.682 . . . . 0.0 109.91 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.22 -36.6 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 109.357 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 40.9 m -73.43 -42.98 61.35 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.404 -0.81 . . . . 0.0 109.381 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.502 ' HG2' ' HA ' ' A' ' 7' ' ' CYS . 3.9 pt20 -83.28 -5.26 59.07 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 121.362 -0.836 . . . . 0.0 110.472 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.527 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -90.43 -51.71 5.28 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.8 mt -63.47 -49.33 74.06 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.035 176.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.436 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.15 -21.79 65.34 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.56 ' OD1' ' CD2' ' A' ' 18' ' ' HIS . 4.1 t-20 -55.98 -59.59 4.69 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.6 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -57.26 -22.95 45.04 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.658 -1.217 . . . . 0.0 108.036 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.46 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.0 OUTLIER -74.72 -41.24 60.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.64 -0.824 . . . . 0.0 109.28 179.117 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 6.9 t -90.33 -42.81 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.212 -0.93 . . . . 0.0 110.033 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.56 ' CD2' ' OD1' ' A' ' 14' ' ' ASN . 6.2 m-70 -67.67 -36.94 81.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.427 -0.796 . . . . 0.0 110.843 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -90.17 -42.64 10.94 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.348 -178.286 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.486 ' O ' ' CD2' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -91.71 -42.5 10.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.02 -1.05 . . . . 0.0 112.9 -177.925 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.497 ' HB2' ' HA ' ' A' ' 17' ' ' VAL . 0.9 OUTLIER -92.37 -36.18 13.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.973 -1.079 . . . . 0.0 112.561 -177.747 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.518 ' HB2' ' HA ' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -61.27 -46.64 89.52 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.987 -1.071 . . . . 0.0 111.39 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.486 ' CD2' ' O ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -53.21 -30.29 36.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.042 -1.036 . . . . 0.0 109.482 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.445 ' O ' ' CB ' ' A' ' 28' ' ' SER . . . -82.31 -32.09 29.31 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 108.948 -1.661 . . . . 0.0 108.948 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' A' ' 28' ' ' SER . . . -62.62 -16.07 54.89 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.459 -1.024 . . . . 0.0 109.821 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.598 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.3 mm -91.68 -44.19 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' O ' HG23 ' A' ' 30' ' ' THR 0.25 0.9 OUTLIER -71.85 -7.75 50.22 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 175.901 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 m -90.74 -16.46 28.39 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.465 0.65 . . . . 0.0 110.262 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 30' ' ' THR . 0.1 OUTLIER -66.84 -32.83 74.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.941 . . . . 0.0 111.398 -178.433 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -43.26 -71.08 0.09 Allowed 'General case' 0 C--N 1.292 -1.907 0 CA-C-O 121.916 0.865 . . . . 0.0 109.069 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.501 ' O ' ' CB ' ' A' ' 32' ' ' VAL . 26.1 t30 -139.09 8.04 2.47 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.52 ' CG1' ' O ' ' A' ' 34' ' ' SER . 0.4 OUTLIER 73.99 0.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.401 -0.812 . . . . 0.0 110.259 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.14 -56.79 4.59 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -159.28 171.57 19.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.181 -1.188 . . . . 0.0 110.31 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 46.09 76.65 0.09 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.127 -0.983 . . . . 0.0 109.923 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.456 ' O ' ' OXT' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -124.76 67.32 1.1 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.303 -0.873 . . . . 0.0 110.394 -179.782 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.456 ' OXT' ' O ' ' A' ' 36' ' ' THR . 51.9 p90 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 117.894 -1.05 . . . . 0.0 110.091 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.9 mptt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.378 0.608 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.523 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 40.0 t -177.07 -95.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.523 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 17.7 t-20 173.46 24.21 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.569 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 0.0 OUTLIER 167.02 113.43 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.475 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -42.6 -16.59 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.316 -0.865 . . . . 0.0 111.365 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.569 ' CG2' ' HB ' ' A' ' 4' ' ' THR . 3.3 t -87.33 -30.41 20.85 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.027 -1.046 . . . . 0.0 108.285 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' HG22 ' A' ' 6' ' ' THR . 11.8 p -85.12 -38.13 19.43 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -64.69 -46.92 80.34 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.476 ' O ' ' HB1' ' A' ' 13' ' ' ALA . 3.3 p -58.79 -42.11 88.29 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.483 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 11.5 mm-40 -75.57 -13.93 60.37 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 121.507 0.67 . . . . 0.0 109.804 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.446 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 12.4 tpp180 -90.12 -43.09 10.7 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -62.27 -44.54 96.3 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.557 -1.201 . . . . 0.0 108.767 177.183 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.7 -25.6 67.39 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.523 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t30 -58.79 -44.35 90.7 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.89 -19.59 34.51 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.547 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.3 tp -71.87 -63.9 1.04 Allowed 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.218 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.557 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 64.3 t -61.44 -25.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.045 . . . . 0.0 109.697 179.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 16.0 m-70 -86.66 -53.03 5.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.251 -0.906 . . . . 0.0 110.648 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -79.56 -25.12 41.69 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.268 -0.895 . . . . 0.0 111.278 -178.897 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.6 t -90.48 -42.94 10.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.02 -1.05 . . . . 0.0 110.847 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.557 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 6.9 t-20 -66.35 -54.5 23.79 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.065 -1.022 . . . . 0.0 110.257 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.529 ' O ' HG12 ' A' ' 26' ' ' ILE . 5.1 m120 -56.4 -31.13 63.57 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 110.195 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.518 ' CD1' ' C ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -75.11 -51.79 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.164 -0.96 . . . . 0.0 110.908 -179.349 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.98 -33.94 8.61 Favored Glycine 0 N--CA 1.493 2.484 0 C-N-CA 119.981 -1.104 . . . . 0.0 110.929 -178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.54 ' CB ' ' O ' ' A' ' 21' ' ' ASN . . . -70.44 -28.97 65.44 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.012 -1.287 . . . . 0.0 111.416 -178.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.529 HG12 ' O ' ' A' ' 22' ' ' ASN . 5.8 mm -92.1 -41.47 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.659 -1.275 . . . . 0.0 108.351 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.478 ' CD1' ' O ' ' A' ' 23' ' ' PHE . 11.2 mt -51.45 -25.23 6.03 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.132 -1.432 . . . . 0.0 107.132 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.484 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.3 m -68.03 -8.95 42.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.998 179.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.44 ' HB3' ' HA ' ' A' ' 32' ' ' VAL . 24.6 m -158.47 59.28 0.45 Allowed 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.456 -0.777 . . . . 0.0 109.606 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 4.8 t -56.0 -42.01 75.76 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.007 0.908 . . . . 0.0 108.961 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.595 ' N ' ' CG2' ' A' ' 30' ' ' THR . 5.1 p-10 -95.33 9.89 38.21 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.585 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 9.8 t 60.47 50.32 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-O 122.32 1.057 . . . . 0.0 109.382 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . -118.19 -100.47 2.02 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLY . 0.3 OUTLIER 41.34 27.16 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -1.143 . . . . 0.0 110.35 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 33' ' ' GLY . 18.4 t-20 -134.94 53.68 1.98 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.411 -0.806 . . . . 0.0 109.874 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.48 94.85 3.38 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.787 . . . . 0.0 110.084 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 p90 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 118.047 -0.978 . . . . 0.0 109.98 179.974 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 2' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.281 0.562 . . . . 0.0 110.209 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' C ' ' O ' ' A' ' 1' ' ' LYS . 44.4 t -40.42 -70.6 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.493 -0.754 . . . . 0.0 110.469 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 6.9 t30 178.8 -37.07 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.551 ' CG2' HG21 ' A' ' 6' ' ' THR . 0.7 OUTLIER -126.89 127.17 44.5 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.516 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.93 -21.29 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.551 HG21 ' CG2' ' A' ' 4' ' ' THR . 7.2 t -75.6 -37.74 59.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.093 -1.005 . . . . 0.0 109.644 179.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.487 ' HB3' HG23 ' A' ' 4' ' ' THR . 36.0 t -83.15 -62.52 1.57 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.747 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.485 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -43.22 -63.33 0.83 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.124 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.535 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 91.9 m -48.5 -42.05 31.74 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.793 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.515 ' HB2' ' O ' ' A' ' 6' ' ' THR . 6.2 tt0 -61.07 -31.6 71.26 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 121.044 -1.035 . . . . 0.0 110.949 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' CG ' ' CZ ' ' A' ' 15' ' ' PHE . 17.3 ttp85 -92.2 -44.98 8.48 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.833 -1.167 . . . . 0.0 107.853 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.488 HD11 ' N ' ' A' ' 12' ' ' LEU . 5.5 mp -61.83 -45.77 92.39 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.538 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.74 -28.67 68.6 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -54.04 -42.61 69.4 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.842 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.32 -18.31 28.76 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.657 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.528 ' O ' ' CB ' ' A' ' 20' ' ' SER . 6.7 tp -71.76 -36.57 70.44 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.444 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.543 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 34.2 t -87.83 -35.52 8.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.166 -0.959 . . . . 0.0 109.347 178.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 6.9 m-70 -79.29 -48.54 13.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.412 -0.805 . . . . 0.0 111.211 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -90.13 -29.68 18.14 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.917 -1.114 . . . . 0.0 112.287 -178.3 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -91.05 -27.16 18.79 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.695 -1.253 . . . . 0.0 111.971 -178.747 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 5.9 t-20 -76.42 -34.01 58.8 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.656 -1.277 . . . . 0.0 110.804 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.494 ' O ' HG12 ' A' ' 26' ' ' ILE . 55.1 t30 -81.13 -44.66 17.58 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.966 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.503 ' CE2' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -57.74 -36.3 71.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.326 -0.859 . . . . 0.0 110.156 -179.614 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.468 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -78.28 -27.86 56.95 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -68.23 -22.26 64.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.281 -1.129 . . . . 0.0 111.259 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.585 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.1 mm -91.79 -43.65 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 120.832 -1.167 . . . . 0.0 108.655 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.503 HD23 ' CE2' ' A' ' 23' ' ' PHE . 6.2 mp -49.08 -26.4 2.66 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.454 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.0 m -62.28 -20.79 64.64 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.607 0.718 . . . . 0.0 109.645 178.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.605 ' O ' ' CB ' ' A' ' 30' ' ' THR . 22.3 m -148.03 -72.61 0.2 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.717 -0.615 . . . . 0.0 109.792 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.605 ' CB ' ' O ' ' A' ' 29' ' ' SER . 0.6 OUTLIER 91.51 -39.26 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.295 0 CA-C-O 121.49 0.662 . . . . 0.0 109.696 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.543 ' N ' HG23 ' A' ' 30' ' ' THR . 52.2 p-10 -156.21 12.14 0.29 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.569 -0.707 . . . . 0.0 110.387 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.49 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.4 OUTLIER 53.91 18.52 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.121 -0.987 . . . . 0.0 110.074 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -132.85 3.42 4.94 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.4 t -79.31 116.3 19.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.176 -1.191 . . . . 0.0 110.178 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.432 ' O ' ' CG2' ' A' ' 36' ' ' THR . 1.4 t-20 -85.38 54.85 3.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 110.368 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.432 ' CG2' ' O ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER 178.41 48.15 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.313 -0.867 . . . . 0.0 110.237 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.7 p90 . . . . . 0 C--N 1.302 -1.467 0 CA-C-O 117.879 -1.057 . . . . 0.0 110.424 -179.937 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.296 0.57 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 52.1 t -64.42 -80.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.241 -0.912 . . . . 0.0 110.442 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 11.1 t-20 179.0 -35.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.526 ' O ' ' N ' ' A' ' 7' ' ' CYS . 59.4 p -119.02 120.95 38.74 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.479 ' O ' HG21 ' A' ' 9' ' ' THR . . . -40.97 -25.18 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.953 -0.699 . . . . 0.0 109.544 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.525 HG22 ' CB ' ' A' ' 4' ' ' THR . 9.0 t -74.67 -35.73 62.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.412 -0.805 . . . . 0.0 109.91 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.6 t -80.07 -56.64 4.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.435 -0.791 . . . . 0.0 109.823 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -47.17 -62.86 1.22 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.119 -0.988 . . . . 0.0 108.768 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.578 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 58.4 p -52.93 -36.83 60.25 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.483 178.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -60.35 -32.69 71.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.78 -1.2 . . . . 0.0 110.232 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.49 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -91.76 -46.35 7.94 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.703 1.24 . . . . 0.0 107.805 179.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.9 mp -61.9 -57.47 11.64 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.048 178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.578 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -59.17 -26.45 64.78 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.591 ' O ' ' CG ' ' A' ' 18' ' ' HIS . 16.7 t-20 -47.98 -50.19 28.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.473 ' O ' ' HB3' ' A' ' 19' ' ' SER . 0.7 OUTLIER -92.96 -25.28 18.08 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.548 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.0 -37.96 75.83 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.892 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.433 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 11.1 t -87.69 -30.69 5.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 O-C-N 121.199 -0.938 . . . . 0.0 109.155 179.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.591 ' CG ' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -81.4 -47.12 13.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.6 -0.688 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -87.09 -31.81 20.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.128 -0.983 . . . . 0.0 111.7 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.613 ' O ' ' CE1' ' A' ' 23' ' ' PHE . 0.1 OUTLIER -91.89 -40.08 11.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.088 . . . . 0.0 111.908 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 5.7 t-20 -83.69 -10.98 57.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.887 -1.133 . . . . 0.0 111.657 -178.578 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.534 ' O ' HG12 ' A' ' 26' ' ' ILE . 3.1 t30 -55.57 -55.97 25.74 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.924 -1.11 . . . . 0.0 110.926 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.613 ' CE1' ' O ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -48.8 -21.5 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.052 -1.03 . . . . 0.0 110.346 -179.61 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.558 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.36 -47.61 3.74 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -64.93 -20.82 66.66 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -1.135 . . . . 0.0 111.128 -179.154 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.534 HG12 ' O ' ' A' ' 22' ' ' ASN . 15.9 mm -92.56 -35.18 6.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 120.878 -1.139 . . . . 0.0 108.349 179.14 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 23' ' ' PHE . 10.7 mt -50.19 -27.49 5.98 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 176.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.479 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.1 m -56.26 -23.17 34.61 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.875 0.845 . . . . 0.0 108.818 177.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.599 ' O ' HG22 ' A' ' 30' ' ' THR . 10.3 m -144.19 -76.77 0.23 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.809 -0.557 . . . . 0.0 109.531 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.599 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 67.31 -53.32 0.48 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 110.22 179.758 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.576 ' N ' HG21 ' A' ' 30' ' ' THR . 13.0 p-10 -113.55 0.14 14.57 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.466 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.467 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.5 OUTLIER 59.8 15.17 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.78 . . . . 0.0 110.345 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 114.79 113.79 2.99 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 33' ' ' GLY . 70.9 m -41.75 127.84 3.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.36 -1.082 . . . . 0.0 110.223 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -139.51 102.7 4.53 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.246 -0.909 . . . . 0.0 110.376 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.67 93.84 4.74 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -0.894 . . . . 0.0 109.846 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.509 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 6.9 p90 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.347 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.129 0.49 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.616 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 2.5 m -110.29 -108.43 0.34 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.144 -0.973 . . . . 0.0 110.105 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.616 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 6.5 t30 149.17 -28.18 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.54 ' O ' ' N ' ' A' ' 6' ' ' THR . 80.5 p -84.38 107.5 16.68 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.541 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -35.56 -30.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.35 0.595 . . . . 0.0 109.843 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.54 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.6 t -57.41 -45.93 84.03 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.696 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.9 t -89.14 -45.12 9.83 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.473 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -55.12 -54.3 44.92 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.541 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 28.2 m -57.81 -42.19 83.75 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.152 -0.967 . . . . 0.0 109.025 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 6' ' ' THR . 21.7 mm-40 -71.74 -18.22 62.15 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.176 -0.952 . . . . 0.0 109.977 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.573 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -90.49 -49.86 6.27 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 178.757 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -56.7 -46.43 81.24 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.614 176.81 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.52 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -60.35 -32.22 71.06 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.485 0.66 . . . . 0.0 109.268 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.569 ' O ' ' CD2' ' A' ' 18' ' ' HIS . 4.8 t-20 -57.88 -44.54 86.74 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.582 -0.699 . . . . 0.0 109.298 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.573 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 1.0 OUTLIER -87.82 -22.78 24.29 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.485 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.556 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.0 OUTLIER -72.94 -53.15 12.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.251 -0.979 . . . . 0.0 109.19 179.724 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 48.3 t -66.49 -29.53 46.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.111 -0.993 . . . . 0.0 109.348 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 14' ' ' ASN . 10.7 m-70 -86.34 -57.82 2.86 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.351 -0.843 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.8 t -69.41 -26.66 64.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.466 -0.772 . . . . 0.0 111.664 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.585 ' O ' ' CD2' ' A' ' 23' ' ' PHE . 2.7 t -90.66 -46.49 8.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.032 -1.042 . . . . 0.0 110.892 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 39.6 t30 -64.75 -9.96 24.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.0 110.93 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' O ' ' N ' ' A' ' 25' ' ' ALA . 1.3 m-20 -51.95 -65.69 0.51 Allowed 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.064 -1.022 . . . . 0.0 111.428 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.585 ' CD2' ' O ' ' A' ' 20' ' ' SER . 7.9 p90 -47.33 -28.78 2.15 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.048 -1.032 . . . . 0.0 109.467 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.508 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -70.77 -38.18 66.4 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.704 -1.759 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -66.7 -9.99 42.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.434 -1.039 . . . . 0.0 109.785 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.555 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.1 mm -90.83 -48.08 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.9 mm? -49.11 -24.71 1.74 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.2 m -66.81 -3.72 7.48 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.95 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.461 ' O ' HG21 ' A' ' 30' ' ' THR . 26.4 m -116.61 33.04 5.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.995 -1.066 . . . . 0.0 110.939 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.461 HG21 ' O ' ' A' ' 29' ' ' SER . 67.4 p -151.5 -87.5 0.07 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.103 -0.998 . . . . 0.0 110.193 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.533 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 26.1 t30 -87.47 -47.98 8.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.2 -0.937 . . . . 0.0 109.938 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.533 ' CG1' ' O ' ' A' ' 31' ' ' ASN . 6.8 p 41.84 25.81 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.667 -0.646 . . . . 0.0 110.445 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.494 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . 31.86 52.27 0.35 Allowed Glycine 0 N--CA 1.498 2.783 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 78.6 p -113.34 100.34 8.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.114 -1.227 . . . . 0.0 110.657 -179.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.484 ' O ' ' HB ' ' A' ' 36' ' ' THR . 2.7 p-10 179.15 48.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.135 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.484 ' HB ' ' O ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER 167.47 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.569 -0.707 . . . . 0.0 109.877 179.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.4 p90 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.089 -0.957 . . . . 0.0 110.062 -179.936 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.3 0.571 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.8 OUTLIER -58.08 -89.74 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.214 -0.929 . . . . 0.0 110.617 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.541 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.6 t-20 159.27 -28.39 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -179.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.552 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 1.4 p -94.92 112.76 24.45 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.474 ' O ' HG22 ' A' ' 9' ' ' THR . . . -38.48 -25.34 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.823 -0.548 . . . . 0.0 110.682 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.552 ' CG2' ' HB ' ' A' ' 4' ' ' THR . 1.5 t -72.61 -33.96 67.05 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.873 -1.142 . . . . 0.0 109.221 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' ' O ' ' A' ' 4' ' ' THR . 36.8 t -89.72 -38.07 14.11 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.271 -0.893 . . . . 0.0 108.807 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -60.35 -56.5 20.7 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 5' ' ' ALA . 81.5 p -60.14 -38.32 82.75 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.363 -0.935 . . . . 0.0 108.948 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.476 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -73.58 -19.83 60.77 Favored 'General case' 0 N--CA 1.486 1.342 0 O-C-N 121.225 -0.922 . . . . 0.0 110.201 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.0 tpm_? -90.71 -43.06 10.36 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.561 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -60.58 -41.14 94.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.493 177.135 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.52 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.44 -28.35 68.53 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.23 -47.9 77.55 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' O ' ' CB ' ' A' ' 19' ' ' SER . 7.0 m-85 -68.31 -21.35 64.77 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.696 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.52 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -64.47 -54.15 37.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.852 . . . . 0.0 109.727 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -72.77 -33.25 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.288 -0.883 . . . . 0.0 110.02 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -79.5 -58.47 3.19 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.138 -0.976 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.569 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 6.7 t -52.99 -22.95 6.32 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.001 -1.062 . . . . 0.0 110.077 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.599 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 31.5 t -81.68 -31.93 31.98 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -91.2 -22.35 20.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.3 -0.875 . . . . 0.0 109.992 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.548 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -57.86 -46.51 84.72 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.242 -0.911 . . . . 0.0 110.762 -179.534 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.599 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.4 OUTLIER -47.87 -23.06 0.66 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.379 -0.826 . . . . 0.0 110.107 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.582 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -78.92 -45.47 9.11 Favored Glycine 0 N--CA 1.487 2.058 0 N-CA-C 108.494 -1.842 . . . . 0.0 108.494 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -61.83 -11.43 12.55 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.411 -1.052 . . . . 0.0 110.215 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.598 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.8 mm -91.94 -40.62 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 12.1 mt -47.21 -28.43 1.88 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 176.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.9 m -59.29 -17.22 27.05 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.257 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.94 18.95 8.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.447 -0.783 . . . . 0.0 110.551 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.509 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 32.3 p -138.93 -76.04 0.37 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.271 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.589 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 17.1 t-20 -53.41 -23.81 10.8 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 109.702 179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.589 ' CG1' ' O ' ' A' ' 31' ' ' ASN . 11.3 p 42.22 28.81 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 CA-C-O 121.652 0.739 . . . . 0.0 110.08 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 77.38 14.8 82.13 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 33' ' ' GLY . 54.2 p 42.35 -149.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.221 -1.164 . . . . 0.0 110.191 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -163.97 95.4 0.78 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.368 -0.833 . . . . 0.0 110.055 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.02 70.07 6.32 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.935 . . . . 0.0 110.218 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.549 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 35.5 p90 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.25 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.1 0.476 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.6 OUTLIER -107.31 -91.6 0.42 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.124 -0.985 . . . . 0.0 110.377 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.2 t-20 159.98 -27.22 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.541 ' O ' ' N ' ' A' ' 7' ' ' CYS . 2.6 t -103.82 115.99 31.47 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.688 0.756 . . . . 0.0 109.972 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.454 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.73 -25.94 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.615 -0.678 . . . . 0.0 109.911 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.536 HG23 ' CG2' ' A' ' 4' ' ' THR . 2.0 t -64.47 -39.8 94.49 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.541 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.2 t -89.72 -32.73 16.87 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.474 ' O ' HD13 ' A' ' 12' ' ' LEU . . . -66.31 -49.38 67.24 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.0 m -59.71 -39.22 83.9 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.474 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.9 OUTLIER -75.03 -20.01 59.78 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.501 -0.749 . . . . 0.0 109.519 178.977 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 7' ' ' CYS . 1.4 mmt85 -84.84 -41.93 15.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.534 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -59.04 -30.42 68.03 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.198 -1.365 . . . . 0.0 107.973 176.488 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.523 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.64 -35.24 78.53 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 122.003 0.906 . . . . 0.0 108.618 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -58.28 -45.64 87.55 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.1 m-85 -70.54 -19.94 62.85 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.523 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.0 OUTLIER -57.67 -32.32 67.2 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.6 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.6 -46.2 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.684 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.484 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 5.3 m-70 -69.7 -47.52 62.87 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.177 -0.952 . . . . 0.0 109.824 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.7 t -64.25 -56.14 16.67 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.239 -0.913 . . . . 0.0 109.112 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.491 ' OG ' ' O ' ' A' ' 16' ' ' LEU . 82.1 p -46.71 -35.97 6.66 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.228 -0.92 . . . . 0.0 109.083 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -50.32 -26.19 4.57 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.047 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.489 ' HB2' ' O ' ' A' ' 19' ' ' SER . 28.9 m-20 -47.96 -25.08 1.23 Allowed 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.504 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ILE . 3.3 m-85 -56.82 -50.51 72.16 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -51.02 -31.13 24.82 Favored Glycine 0 N--CA 1.483 1.828 0 N-CA-C 107.284 -2.326 . . . . 0.0 107.284 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.464 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -71.11 -24.16 62.24 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.729 -0.865 . . . . 0.0 109.598 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.503 ' N ' HD12 ' A' ' 26' ' ' ILE . 3.7 mm -91.8 -44.78 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.447 ' HG ' ' HB ' ' A' ' 36' ' ' THR . 7.4 mp -45.92 -28.64 1.17 Allowed 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.464 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.8 m -51.11 -52.52 42.91 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.584 0.707 . . . . 0.0 109.681 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.562 ' O ' ' CG2' ' A' ' 30' ' ' THR . 0.4 OUTLIER -79.5 -46.97 16.41 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.422 -0.799 . . . . 0.0 110.159 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.562 ' CG2' ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 77.17 -15.13 0.77 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.718 -0.614 . . . . 0.0 110.707 179.889 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.509 ' C ' ' ND2' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -54.41 -14.86 1.36 Allowed 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.39 -0.819 . . . . 0.0 109.36 179.484 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.9 p -49.57 -17.48 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.905 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' N ' ' C ' ' A' ' 31' ' ' ASN . . . 154.66 39.71 0.02 OUTLIER Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 47.14 37.49 5.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.301 -1.117 . . . . 0.0 109.92 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.42 ' O ' ' OG1' ' A' ' 36' ' ' THR . 0.3 OUTLIER -133.25 -168.52 2.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.337 -0.852 . . . . 0.0 110.021 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.447 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 20.8 p 45.27 74.41 0.13 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.329 -0.857 . . . . 0.0 110.007 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.422 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 1.7 p90 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.221 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.314 0.578 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.509 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 13.2 m -133.8 -106.4 0.24 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 110.066 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.542 ' O ' ' CB ' ' A' ' 4' ' ' THR . 7.4 t-20 -137.96 25.18 2.78 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.767 -1.208 . . . . 0.0 109.714 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.586 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 3.5 m 80.03 -87.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.682 -0.636 . . . . 0.0 110.559 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -46.71 -20.9 0.15 Allowed 'General case' 0 C--N 1.293 -1.88 0 O-C-N 120.358 -1.464 . . . . 0.0 108.615 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.1 m -92.49 -65.66 0.98 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.458 -0.776 . . . . 0.0 110.647 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.509 ' SG ' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -67.49 -32.87 73.98 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.305 -0.872 . . . . 0.0 108.956 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.586 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -66.31 -55.03 17.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.402 -0.811 . . . . 0.0 109.015 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 79.5 m -57.95 -28.65 64.5 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.596 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.476 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 10.4 mm-40 -88.49 -11.25 46.37 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 121.542 -0.724 . . . . 0.0 110.149 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 21.4 ttp180 -89.92 -48.35 7.28 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.8 mt -61.52 -43.96 97.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.647 -1.16 . . . . 0.0 107.955 176.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.483 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.13 -22.48 66.94 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 21.8 t30 -58.17 -49.36 77.29 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 m-30 -63.82 -24.72 67.86 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.551 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -63.1 -49.92 72.53 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.397 179.377 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.2 t -81.46 -31.43 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.441 -0.787 . . . . 0.0 109.942 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -74.08 -57.12 4.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.412 -0.805 . . . . 0.0 110.187 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.464 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -69.48 -17.35 63.6 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.995 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.588 ' HA ' ' CE2' ' A' ' 23' ' ' PHE . 1.2 t -67.87 -48.16 66.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.383 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.74 -29.49 68.73 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.419 -0.8 . . . . 0.0 110.316 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.526 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -64.4 -65.68 0.64 Allowed 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.771 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.588 ' CE2' ' HA ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -68.01 -19.53 64.93 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.706 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.75 -32.32 54.15 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 108.284 -1.926 . . . . 0.0 108.284 178.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -73.98 -19.16 60.74 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.63 -0.924 . . . . 0.0 110.223 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.605 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.8 mm -89.96 -48.51 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' HA ' HG21 ' A' ' 30' ' ' THR . 4.8 mp -49.34 -24.86 2.07 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.477 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.7 m -73.96 3.88 6.19 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.722 179.073 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 26' ' ' ILE . 3.5 m -167.23 54.3 0.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.087 -1.008 . . . . 0.0 109.456 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.494 HG21 ' HA ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -113.14 -82.09 0.59 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.475 -0.766 . . . . 0.0 110.438 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -140.58 5.43 2.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -179.543 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.9 p -70.79 -1.93 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.101 -0.999 . . . . 0.0 110.25 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' O ' ' A' ' 34' ' ' SER . . . 173.8 -72.37 0.09 OUTLIER Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.268 -1.533 . . . . 0.0 109.268 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.44 ' O ' ' O ' ' A' ' 33' ' ' GLY . 0.7 OUTLIER 57.29 113.91 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -1.09 . . . . 0.0 110.482 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.427 ' C ' ' OG1' ' A' ' 36' ' ' THR . 55.1 t30 -73.71 62.15 0.79 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.298 -0.876 . . . . 0.0 109.913 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.427 ' OG1' ' C ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -162.87 65.69 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.22 -0.925 . . . . 0.0 110.329 -179.633 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 p90 . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.161 179.909 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.41 0.624 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.3 OUTLIER -53.38 -83.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 0.0 110.624 -179.959 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 8.0 t-20 163.35 -27.58 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.432 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.53 ' HB ' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -120.8 121.69 38.72 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.636 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.55 -25.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.62 0.724 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.53 HG23 ' HB ' ' A' ' 4' ' ' THR . 8.0 t -78.75 -44.61 22.96 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.498 -0.751 . . . . 0.0 109.525 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' HG22 ' A' ' 6' ' ' THR . 44.3 t -61.44 -47.16 87.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.463 -0.773 . . . . 0.0 109.185 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -56.95 -48.84 77.36 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.698 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.425 ' O ' ' N ' ' A' ' 13' ' ' ALA . 17.5 m -63.11 -42.48 99.58 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.51 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -66.29 -20.8 66.2 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.477 -0.764 . . . . 0.0 109.804 179.376 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -90.04 -48.87 6.92 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 178.551 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -58.77 -31.81 68.72 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.825 176.669 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.558 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.39 -27.99 61.77 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.796 0.808 . . . . 0.0 108.998 179.013 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.492 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 6.5 t-20 -60.45 -43.19 97.1 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.759 -0.588 . . . . 0.0 109.822 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.16 -16.53 33.13 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.162 179.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.558 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.3 mt -70.53 -49.29 49.69 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.815 -179.863 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 29.8 t -76.66 -36.43 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.413 -0.805 . . . . 0.0 109.852 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.492 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 27.5 m-70 -77.93 -55.78 5.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.455 -0.778 . . . . 0.0 111.279 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.496 ' O ' ' HB3' ' A' ' 23' ' ' PHE . 0.9 OUTLIER -75.76 -36.73 59.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.269 -0.894 . . . . 0.0 112.358 -178.047 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.468 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.4 OUTLIER -92.17 -40.9 10.75 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.758 -1.214 . . . . 0.0 112.456 -178.618 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.409 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 0.1 OUTLIER -91.35 -38.65 12.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.995 -1.066 . . . . 0.0 112.83 -177.837 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.487 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -78.06 -41.14 36.46 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.798 -1.189 . . . . 0.0 111.667 -178.155 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.519 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 0.0 OUTLIER -59.46 -43.16 93.24 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.191 -0.943 . . . . 0.0 109.767 -179.6 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -84.05 -13.81 73.63 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.813 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.443 ' HB3' ' HA ' ' A' ' 22' ' ' ASN . . . -72.55 -27.94 62.53 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -1.1 . . . . 0.0 110.539 -179.718 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.606 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.6 mm -91.4 -47.73 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.413 ' N ' ' CD2' ' A' ' 27' ' ' LEU . 3.8 mm? -53.84 -22.01 8.79 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 176.036 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.474 ' OG ' ' O ' ' A' ' 24' ' ' GLY . 1.8 m -72.97 0.06 12.34 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.716 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -137.34 45.65 2.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.088 -1.007 . . . . 0.0 110.492 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.531 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 26.0 p -131.77 -75.83 0.51 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.434 -0.791 . . . . 0.0 110.283 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.531 ' N ' ' OG1' ' A' ' 30' ' ' THR . 1.4 p30 -87.04 -9.35 55.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.203 -0.936 . . . . 0.0 110.39 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.432 ' O ' ' C ' ' A' ' 33' ' ' GLY . 53.9 t -128.27 -76.5 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -0.868 . . . . 0.0 109.968 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.432 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . 41.15 38.35 1.8 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.415 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 0.7 OUTLIER -178.63 -169.91 0.19 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.158 -1.201 . . . . 0.0 110.277 179.924 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.415 ' CB ' ' O ' ' A' ' 34' ' ' SER . 4.5 t-20 63.48 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.25 -0.906 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.473 ' O ' ' O ' ' A' ' 37' ' ' TYR . 6.7 t -126.16 78.84 1.8 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 109.947 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.4 p90 . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 117.889 -1.053 . . . . 0.0 110.384 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.2 0.524 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -139.64 -74.79 0.36 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.22 -0.925 . . . . 0.0 110.494 -179.634 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.4 t30 160.81 -33.62 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -179.373 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.538 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -100.2 119.33 38.2 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.963 178.377 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.495 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.52 -23.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.826 -0.546 . . . . 0.0 110.177 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.538 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -77.65 -41.22 39.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.143 -0.973 . . . . 0.0 109.519 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.532 ' N ' HG23 ' A' ' 6' ' ' THR . 38.3 t -86.13 -48.78 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.145 178.951 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.46 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -54.1 -53.31 54.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.025 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 52.3 m -54.33 -42.91 70.74 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.719 178.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -74.23 -18.81 60.69 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.312 -0.867 . . . . 0.0 110.653 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.3 mmt85 -90.1 -37.88 13.94 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.271 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.46 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -68.3 -31.64 71.23 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.276 177.974 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.504 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.83 -32.45 67.55 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.758 0.79 . . . . 0.0 108.869 178.82 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 18.0 t30 -59.04 -44.02 91.72 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.424 0.63 . . . . 0.0 109.644 179.314 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -79.78 -16.93 54.6 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.168 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -68.29 -54.9 14.33 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.541 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -78.44 -19.86 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.332 -0.855 . . . . 0.0 110.105 179.652 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.466 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 15.1 m170 -88.6 -56.98 3.08 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.036 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.6 p -62.2 -21.03 64.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.432 -0.792 . . . . 0.0 110.587 -179.624 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.591 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 22.8 t -90.79 -37.48 13.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.075 -1.015 . . . . 0.0 110.37 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 24' ' ' GLY . 16.9 t-20 -85.73 -4.7 59.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.339 -0.85 . . . . 0.0 110.535 -179.737 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 21' ' ' ASN . 8.1 t-20 -44.86 -52.67 8.33 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.224 -0.923 . . . . 0.0 109.784 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 5.1 p90 -49.61 -29.94 7.97 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.455 -0.778 . . . . 0.0 108.936 179.424 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.624 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -79.6 -34.51 31.45 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.204 -1.558 . . . . 0.0 109.204 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -58.06 -18.51 25.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.291 -1.123 . . . . 0.0 109.783 179.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.588 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.3 mm -91.48 -42.07 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 179.403 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.517 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 5.8 mp -52.39 -23.04 5.32 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.616 -1.254 . . . . 0.0 107.616 176.422 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.1 m -66.89 -12.42 59.3 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.51 179.595 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.411 ' C ' HG23 ' A' ' 30' ' ' THR . 0.4 OUTLIER -136.4 45.15 2.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.199 -0.938 . . . . 0.0 110.424 -179.612 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.468 HG23 ' O ' ' A' ' 26' ' ' ILE . 60.5 p -145.52 -76.5 0.21 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.427 -0.796 . . . . 0.0 109.855 179.888 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.517 ' ND2' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -53.56 -24.69 14.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.303 -0.873 . . . . 0.0 109.641 179.644 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.29 -21.75 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.417 -0.802 . . . . 0.0 109.799 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 60.83 55.72 28.2 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.85 91.28 8.55 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.209 -1.171 . . . . 0.0 110.287 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.4 ' O ' ' HB ' ' A' ' 36' ' ' THR . 30.7 p30 -114.2 -176.23 2.85 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.059 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.401 ' O ' ' C ' ' A' ' 37' ' ' TYR . 34.9 m 54.02 89.67 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.209 -0.932 . . . . 0.0 110.168 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.401 ' C ' ' O ' ' A' ' 36' ' ' THR . 52.2 p90 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.405 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.171 0.51 . . . . 0.0 110.129 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 48.5 t -41.1 -79.06 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.483 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 6.9 t-20 169.78 -32.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.534 ' CG2' HG23 ' A' ' 6' ' ' THR . 1.5 m -114.87 117.94 32.11 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.485 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -39.57 -25.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.69 -0.631 . . . . 0.0 110.043 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.534 HG23 ' CG2' ' A' ' 4' ' ' THR . 3.0 t -75.48 -34.08 60.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.951 . . . . 0.0 110.368 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.3 t -89.9 -60.86 1.82 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.962 . . . . 0.0 109.641 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -44.97 -54.37 6.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.867 . . . . 0.0 109.206 179.136 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.485 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 27.9 m -59.78 -43.45 94.37 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.458 -0.776 . . . . 0.0 110.076 179.579 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.52 65.1 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 121.187 -0.946 . . . . 0.0 110.555 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.604 ' HG3' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.12 -50.07 6.05 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.114 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 8' ' ' ALA 0.262 3.2 mt -58.27 -39.75 80.07 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.25 178.101 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.475 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.8 -34.29 77.82 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.523 -0.736 . . . . 0.0 109.429 179.246 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.496 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 7.4 t30 -56.24 -44.57 79.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.403 -0.81 . . . . 0.0 109.349 179.393 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.621 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -85.44 -20.03 30.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.919 . . . . 0.0 108.877 179.568 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' O ' ' HB3' ' A' ' 20' ' ' SER . 2.0 tp -66.13 -52.71 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.823 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 t -72.1 -30.88 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.163 -0.961 . . . . 0.0 110.29 179.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.43 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 19.5 m-70 -89.8 -66.71 0.9 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.995 . . . . 0.0 110.878 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.2 t -50.95 -23.69 3.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 111.284 -178.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 9.1 p -90.78 -46.89 7.96 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.863 -1.148 . . . . 0.0 111.43 -179.337 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -84.47 -43.98 14.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.138 -0.976 . . . . 0.0 111.396 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.47 ' O ' HG12 ' A' ' 26' ' ' ILE . 5.2 t30 -65.41 -12.46 52.53 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.221 -0.924 . . . . 0.0 111.523 -178.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.486 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -76.65 -65.95 0.87 Allowed 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.927 -1.108 . . . . 0.0 110.612 -179.239 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.407 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -57.94 -22.16 47.44 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.517 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.475 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -70.39 -41.72 72.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 110.741 -179.638 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.498 ' O ' HG23 ' A' ' 30' ' ' THR . 7.7 mm -91.64 -42.28 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.065 -1.022 . . . . 0.0 108.779 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.498 ' N ' HD21 ' A' ' 27' ' ' LEU . 3.9 mm? -46.63 -26.98 1.01 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 176.726 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.475 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.2 m -61.79 -22.61 65.59 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.779 178.845 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.446 ' O ' HG21 ' A' ' 30' ' ' THR . 0.6 OUTLIER -134.74 44.86 2.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.94 . . . . 0.0 110.545 -178.964 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.498 HG23 ' O ' ' A' ' 26' ' ' ILE . 70.1 p -150.31 -55.51 0.16 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 110.041 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -54.25 -19.85 5.99 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.39 -0.819 . . . . 0.0 109.52 179.458 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.493 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 9.6 p -55.1 -19.59 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.853 0.835 . . . . 0.0 109.326 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.428 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -101.51 -29.07 6.43 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.0 p 44.32 73.98 0.14 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -1.09 . . . . 0.0 110.304 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -154.01 52.49 0.69 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.185 -0.947 . . . . 0.0 110.509 179.783 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 48.71 1.69 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.29 -0.881 . . . . 0.0 110.401 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.301 -1.503 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.258 -179.997 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.651 ' HB2' ' N ' ' A' ' 7' ' ' CYS . 5.4 p 169.63 114.75 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.509 -0.745 . . . . 0.0 109.02 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.693 ' O ' ' CB ' ' A' ' 4' ' ' THR . 6.8 t30 -100.52 15.26 28.56 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 112.385 -178.443 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.693 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 1.8 m 139.52 -87.88 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 118.686 0.676 . . . . 0.0 110.638 178.583 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.54 ' N ' ' CG2' ' A' ' 4' ' ' THR . . . -43.53 -22.93 0.05 Allowed 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.567 -1.333 . . . . 0.0 108.995 179.58 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.2 OUTLIER -92.68 -57.96 2.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.569 -0.707 . . . . 0.0 110.907 179.507 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.651 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -77.76 -37.34 49.3 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -179.794 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.59 ' N ' ' O ' ' A' ' 4' ' ' THR . . . -62.56 -52.4 63.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.556 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 31.8 m -59.84 -26.42 65.8 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.06 -1.025 . . . . 0.0 109.267 179.136 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.472 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -89.96 -17.81 27.22 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.441 -0.787 . . . . 0.0 110.69 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -91.2 -39.44 12.1 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.597 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.586 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 2.0 mt -61.96 -49.04 77.69 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.639 -1.164 . . . . 0.0 108.696 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 16' ' ' LEU . . . -65.31 -27.79 68.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.46 ' HB2' ' O ' ' A' ' 10' ' ' GLN . 26.4 t-20 -61.38 -46.48 90.01 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.586 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 3.9 m-85 -62.71 -21.41 65.76 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 178.159 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.468 ' CB ' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -65.77 -53.76 36.06 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.708 179.336 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -80.24 -24.01 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 109.902 179.669 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' O ' ' N ' ' A' ' 22' ' ' ASN . 11.0 m170 -85.63 -62.2 1.58 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.968 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.7 p -51.48 -38.59 54.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.192 -0.943 . . . . 0.0 109.749 179.802 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 45.3 t -65.05 -45.31 85.89 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.385 -0.822 . . . . 0.0 109.682 179.57 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.34 7.39 38.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.838 . . . . 0.0 110.057 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.456 ' O ' HG12 ' A' ' 26' ' ' ILE . 4.9 t30 -67.92 -60.71 2.3 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.295 -0.878 . . . . 0.0 110.298 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.595 ' CE2' ' O ' ' A' ' 20' ' ' SER . 4.8 p90 -53.26 -24.45 11.43 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.313 -0.867 . . . . 0.0 109.615 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.505 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -73.44 -36.97 54.11 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 179.488 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -69.22 -16.88 63.7 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.336 -1.096 . . . . 0.0 109.775 179.768 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.551 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.2 mm -91.88 -50.2 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.455 HD12 ' O ' ' A' ' 23' ' ' PHE . 3.0 mp -50.56 -24.95 3.58 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.487 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.1 m -56.03 -23.44 33.16 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 121.388 0.613 . . . . 0.0 109.92 179.047 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.62 17.88 6.01 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.416 -0.802 . . . . 0.0 109.987 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.539 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 20.5 p -137.21 -75.15 0.41 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.258 -0.901 . . . . 0.0 110.342 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.539 ' N ' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER -53.92 -19.89 5.25 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.178 -0.951 . . . . 0.0 109.445 179.668 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.427 ' HB ' ' O ' ' A' ' 28' ' ' SER . 24.9 t -115.26 -31.2 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.538 -0.727 . . . . 0.0 109.845 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.13 7.67 78.35 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.482 ' CB ' ' O ' ' A' ' 30' ' ' THR . 24.7 t -113.8 39.89 2.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.243 -1.151 . . . . 0.0 110.091 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.44 ' O ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -78.17 151.64 33.13 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.274 -0.891 . . . . 0.0 110.424 -179.922 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.44 ' O ' ' O ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER 50.02 100.65 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.303 -0.873 . . . . 0.0 110.317 179.976 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.169 179.92 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.471 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 1.6 p -78.92 -106.09 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.15 -0.969 . . . . 0.0 110.121 179.59 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.7 t-20 178.55 26.23 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.68 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.576 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER -144.69 95.8 2.76 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.962 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.477 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -33.14 -31.24 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.022 0.439 . . . . 0.0 110.416 -179.441 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.57 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.2 t -62.32 -45.56 92.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.035 -1.041 . . . . 0.0 108.426 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.576 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.0 OUTLIER -67.69 -55.98 11.1 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.71 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.483 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -50.85 -57.79 7.59 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.014 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.494 ' O ' ' N ' ' A' ' 13' ' ' ALA . 15.0 m -54.39 -36.45 63.93 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.326 -0.859 . . . . 0.0 109.553 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.483 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 3.3 tp-100 -65.2 -32.05 73.54 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.297 -0.877 . . . . 0.0 110.319 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.55 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 15.0 tpp180 -87.07 -48.0 8.45 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 178.338 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.493 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 2.1 mt -52.05 -37.57 54.1 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.011 176.541 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.545 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -58.42 -43.94 88.86 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.464 0.649 . . . . 0.0 109.586 179.156 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.458 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 2.3 t30 -49.28 -43.55 43.25 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.251 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.55 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 0.4 OUTLIER -90.2 -19.29 24.37 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.451 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.545 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -67.97 -36.54 80.24 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.345 -0.942 . . . . 0.0 109.45 -179.919 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.7 t -85.17 -34.26 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.366 -0.833 . . . . 0.0 108.849 178.729 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -78.98 -53.75 6.72 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.482 -0.761 . . . . 0.0 110.004 179.539 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 15.5 t -61.98 -39.62 92.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.907 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 12.9 t -56.51 -43.92 80.24 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.298 -0.876 . . . . 0.0 109.293 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -51.27 -42.31 61.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.699 0.761 . . . . 0.0 109.295 179.119 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -84.34 -45.69 12.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.499 -0.75 . . . . 0.0 109.863 179.594 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.467 ' HB3' ' HA ' ' A' ' 20' ' ' SER . 38.9 t80 -51.52 -25.3 6.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.52 -0.737 . . . . 0.0 109.853 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 27' ' ' LEU . . . -86.93 -39.32 7.55 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.467 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -58.54 -23.22 57.81 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.101 -1.235 . . . . 0.0 110.299 -179.834 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.497 HD11 ' N ' ' A' ' 26' ' ' ILE . 5.0 mm -91.76 -34.1 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.345 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' A' ' 24' ' ' GLY . 0.1 OUTLIER -53.2 -20.32 3.88 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.267 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.1 m -71.07 1.41 5.81 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.91 179.464 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.78 52.15 1.1 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.167 -0.958 . . . . 0.0 109.3 -179.746 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.488 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 55.2 p -122.86 -74.7 0.61 Allowed 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.633 -0.667 . . . . 0.0 111.262 -178.704 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' OG1' ' A' ' 30' ' ' THR . 2.8 t-20 -131.28 26.54 4.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.355 -0.841 . . . . 0.0 110.862 -179.327 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.7 p -50.06 -36.46 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.009 -1.057 . . . . 0.0 109.075 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 64.01 6.19 17.86 Favored Glycine 0 N--CA 1.493 2.492 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.474 ' O ' ' HB2' ' A' ' 35' ' ' ASN . 80.3 p 39.23 54.39 2.21 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.052 -1.264 . . . . 0.0 110.642 -179.998 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.532 ' O ' ' C ' ' A' ' 36' ' ' THR . 63.6 m-20 59.63 162.44 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.164 -0.96 . . . . 0.0 110.5 179.874 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.532 ' C ' ' O ' ' A' ' 35' ' ' ASN . 10.6 t 21.65 98.67 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 121.263 0.554 . . . . 0.0 111.847 -179.99 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.509 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 7.9 p90 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.303 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.222 0.534 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.491 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 14.8 t -147.12 -87.58 0.09 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.263 -0.898 . . . . 0.0 110.047 179.894 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 7.7 t-20 179.18 -5.74 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.195 -0.941 . . . . 0.0 111.708 179.836 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.6 HG23 ' HB3' ' A' ' 7' ' ' CYS . 1.7 t 176.11 121.35 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.0 -1.062 . . . . 0.0 109.12 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.467 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -40.06 -17.09 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.799 -0.563 . . . . 0.0 111.597 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.581 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.8 t -77.5 -30.52 53.04 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 120.853 -1.155 . . . . 0.0 108.033 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.6 ' HB3' HG23 ' A' ' 4' ' ' THR . 10.6 p -83.96 -36.3 23.34 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.961 179.249 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.535 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.581 -0.699 . . . . 0.0 109.673 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -75.54 -35.74 60.62 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.082 179.13 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.524 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.2 tp60 -81.04 -19.77 43.11 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.38 -0.825 . . . . 0.0 110.955 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.587 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 10.9 tpp180 -87.49 -41.92 13.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 178.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.537 ' N ' HD21 ' A' ' 12' ' ' LEU . 2.2 mm? -56.09 -31.57 63.35 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.396 176.649 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.541 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.07 -33.18 73.14 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.766 0.793 . . . . 0.0 109.097 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.09 -47.45 81.01 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.587 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 2.9 m-85 -70.44 -22.78 62.67 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.465 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.555 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.5 tp -51.16 -34.02 29.54 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 178.922 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.413 ' O ' ' HB3' ' A' ' 20' ' ' SER . 86.2 t -90.97 -55.33 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 119.966 -0.694 . . . . 0.0 110.112 179.002 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.472 ' O ' ' OD1' ' A' ' 21' ' ' ASN . 10.8 m170 -61.3 -39.56 90.91 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.23 -0.919 . . . . 0.0 110.391 -179.951 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.501 ' N ' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -80.61 -31.39 36.67 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.406 -0.809 . . . . 0.0 108.819 179.249 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -45.28 -43.57 10.7 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.04 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.49 ' OD1' ' N ' ' A' ' 22' ' ' ASN . 10.6 p-10 -44.84 -32.15 1.47 Allowed 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.49 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 3.3 t-20 -80.43 -51.35 8.93 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.209 178.993 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.463 ' O ' HD11 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -54.48 -32.48 57.88 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.529 -0.732 . . . . 0.0 109.052 179.037 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.453 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -84.74 -19.58 59.54 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -67.84 -25.17 65.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -1.108 . . . . 0.0 109.733 179.657 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.587 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.7 mm -91.42 -37.3 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.005 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.495 ' O ' HG21 ' A' ' 30' ' ' THR . 7.6 mp -70.56 -6.56 37.36 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 175.728 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.548 ' O ' ' CG2' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -79.33 5.76 11.68 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.565 0.697 . . . . 0.0 109.43 178.632 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.98 33.9 3.86 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.252 -0.905 . . . . 0.0 108.681 179.691 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.495 HG21 ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -168.28 -61.39 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.774 0.797 . . . . 0.0 110.74 -178.676 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.548 ' ND2' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -72.25 1.97 6.79 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.584 -0.697 . . . . 0.0 109.989 179.914 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.551 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 6.5 t -74.3 11.48 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.12 -0.987 . . . . 0.0 110.454 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.41 ' H ' ' C ' ' A' ' 31' ' ' ASN . . . -84.89 32.88 3.39 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 179.502 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.7 28.24 6.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.113 -1.228 . . . . 0.0 109.766 179.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 51.49 58.17 5.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.477 -0.764 . . . . 0.0 110.178 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.521 ' CG2' ' O ' ' A' ' 36' ' ' THR . 38.3 m -133.22 45.77 2.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.336 -0.853 . . . . 0.0 110.121 179.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.501 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 10.3 p90 . . . . . 0 C--N 1.302 -1.467 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.4 pttp . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.32 0.581 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 38.0 t -59.38 -95.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.456 -0.778 . . . . 0.0 109.48 179.649 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 33.2 t30 178.7 -32.02 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.913 -1.117 . . . . 0.0 108.876 179.336 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.536 ' HB ' ' CG2' ' A' ' 6' ' ' THR . 2.9 p -126.4 119.52 27.49 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.228 179.208 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.44 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -45.22 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.179 -0.951 . . . . 0.0 110.993 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.536 ' CG2' ' HB ' ' A' ' 4' ' ' THR . 6.0 t -86.06 -28.42 24.12 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.003 -1.061 . . . . 0.0 109.709 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' ALA . 14.8 p -88.67 -36.14 16.39 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.613 -0.68 . . . . 0.0 110.085 -179.455 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -72.85 -61.09 1.93 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.511 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -56.72 -31.99 65.06 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.324 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -76.0 -24.89 55.34 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.784 -1.198 . . . . 0.0 110.591 -179.641 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.6 OUTLIER -91.15 -44.07 9.48 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.641 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -61.96 -43.19 99.35 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.568 178.003 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.35 -29.86 70.14 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.447 -0.783 . . . . 0.0 109.403 179.263 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.83 -44.02 97.69 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.55 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.0 OUTLIER -72.59 -20.84 61.23 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.787 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.577 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -61.76 -39.68 92.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.573 179.489 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -86.1 -44.85 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.787 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.481 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 17.6 m-70 -71.66 -51.22 24.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.537 -0.727 . . . . 0.0 110.997 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.9 t -67.43 -42.05 83.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.211 -0.931 . . . . 0.0 110.838 -179.411 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.624 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 3.3 m -49.38 -55.52 12.68 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.96 -1.087 . . . . 0.0 109.837 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.18 5.72 21.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.91 -1.119 . . . . 0.0 109.886 179.415 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.499 ' HB2' ' HA ' ' A' ' 19' ' ' SER . 26.1 t-20 -74.96 -46.71 33.66 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 0.0 110.943 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.624 ' CE2' ' O ' ' A' ' 20' ' ' SER . 3.0 p90 -49.11 -26.26 2.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.094 -1.004 . . . . 0.0 109.435 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.577 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -77.76 -41.94 18.17 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.064 -1.614 . . . . 0.0 109.064 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -67.98 -24.4 65.14 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.436 -1.037 . . . . 0.0 111.221 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.51 ' N ' HD12 ' A' ' 26' ' ' ILE . 4.2 mm -91.73 -44.14 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 108.726 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.522 ' CD2' ' O ' ' A' ' 23' ' ' PHE . 1.3 mp -48.2 -26.45 1.94 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.2 m -59.84 -32.81 71.02 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.913 0.863 . . . . 0.0 108.889 178.335 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.617 ' O ' ' HB ' ' A' ' 30' ' ' THR . 20.6 m -138.68 -81.03 0.32 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.998 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.617 ' HB ' ' O ' ' A' ' 29' ' ' SER . 5.3 t 142.71 -44.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -179.868 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.51 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -160.04 -16.17 0.06 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.292 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.51 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 88.6 t -66.67 -6.88 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.618 -1.301 . . . . 0.0 110.17 -179.483 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 34' ' ' SER . . . 114.56 114.64 3.06 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 3.0 m -55.56 -159.89 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.365 -1.079 . . . . 0.0 110.697 -179.663 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.485 ' CB ' ' O ' ' A' ' 34' ' ' SER . 1.4 t-20 69.16 129.2 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.331 -0.856 . . . . 0.0 110.202 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.564 ' O ' ' C ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -63.22 103.39 0.48 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.211 -0.93 . . . . 0.0 110.234 -179.925 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.59 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 15.0 p90 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.641 179.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 121.269 0.557 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.515 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.8 OUTLIER -136.05 -84.47 0.37 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.14 -0.975 . . . . 0.0 110.694 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.515 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.5 t30 166.34 -28.13 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -179.516 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.55 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -72.78 105.12 4.21 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.604 0.716 . . . . 0.0 109.792 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.86 -22.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.307 -0.871 . . . . 0.0 110.923 179.513 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.54 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -80.44 -38.13 30.68 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.01 -1.056 . . . . 0.0 108.16 179.122 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.55 ' N ' ' O ' ' A' ' 4' ' ' THR . 11.7 p -82.18 -37.31 26.3 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.339 179.436 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.508 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -59.54 -64.32 0.99 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.344 -0.848 . . . . 0.0 108.783 178.909 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.2 m -53.05 -39.1 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.443 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -68.53 -20.72 64.58 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 121.606 -0.683 . . . . 0.0 109.705 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.563 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 5.6 tpm_? -89.76 -49.15 6.8 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 105.769 -1.937 . . . . 0.0 105.769 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.464 HD13 ' N ' ' A' ' 12' ' ' LEU . 8.2 mp -54.79 -35.93 64.37 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.36 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.508 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.95 -27.18 64.53 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.9 t30 -58.75 -45.55 89.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.671 -0.643 . . . . 0.0 109.565 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.563 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 1.5 m-85 -77.64 -17.49 57.7 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.031 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.508 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 tp -66.99 -48.27 68.96 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.433 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.536 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 57.2 t -87.03 -35.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.0 109.983 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 26.5 m170 -67.48 -49.42 63.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.154 -0.966 . . . . 0.0 110.048 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 8.9 t -73.68 -25.91 60.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -0.872 . . . . 0.0 110.385 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 39.2 t -89.74 -36.06 15.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.0 110.346 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.536 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 1.3 t30 -61.68 -22.57 65.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.93 . . . . 0.0 110.036 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -52.45 -71.1 0.07 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.995 -1.065 . . . . 0.0 110.214 -179.955 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' CE2' ' O ' ' A' ' 20' ' ' SER . 9.2 p90 -62.07 -26.83 68.5 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.163 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.07 -28.57 60.19 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.096 -1.602 . . . . 0.0 109.096 179.455 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.488 ' N ' ' O ' ' A' ' 21' ' ' ASN . . . -68.87 -25.57 64.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.336 -1.096 . . . . 0.0 109.613 179.548 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.582 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 2.0 mm -90.36 -42.47 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.398 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.505 ' N ' HD21 ' A' ' 27' ' ' LEU 0.255 0.1 OUTLIER -55.51 -20.43 12.9 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 176.03 . . . . . . . . 4 4 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.0 m -76.34 9.91 2.35 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.885 179.607 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 m -161.79 46.45 0.17 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.895 -1.128 . . . . 0.0 110.532 -179.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.562 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 3.2 p -88.83 -66.31 0.93 Allowed 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.562 ' N ' ' OG1' ' A' ' 30' ' ' THR . 0.7 OUTLIER -88.04 -8.77 55.08 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.74 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.557 ' CG1' ' O ' ' A' ' 31' ' ' ASN . 6.1 p 43.45 35.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.865 0.841 . . . . 0.0 109.801 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . 52.49 54.59 26.58 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.38 87.9 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.221 -1.164 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 33' ' ' GLY . 0.8 OUTLIER -115.25 58.49 0.72 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.303 -0.873 . . . . 0.0 110.595 -179.531 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.461 ' O ' ' C ' ' A' ' 37' ' ' TYR . 2.9 t -55.92 108.44 0.45 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.084 -1.01 . . . . 0.0 109.846 179.677 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.461 ' C ' ' O ' ' A' ' 36' ' ' THR . 15.7 p90 . . . . . 0 N--CA 1.497 1.909 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.686 -179.757 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.193 0.521 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 29.0 m -152.26 -91.48 0.05 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.193 -0.942 . . . . 0.0 110.397 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.55 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.9 t30 158.79 -24.11 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -179.443 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -122.18 118.64 29.09 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.34 0.591 . . . . 0.0 109.411 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.557 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.28 -27.47 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 CA-C-O 121.108 0.48 . . . . 0.0 110.003 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 2.6 t -62.1 -39.33 92.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.979 . . . . 0.0 108.709 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.9 t -86.49 -48.6 8.25 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.673 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.493 ' O ' ' N ' ' A' ' 11' ' ' ARG . . . -57.45 -56.69 18.59 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.547 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.557 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 88.8 m -48.75 -44.21 38.41 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.821 -1.152 . . . . 0.0 108.224 178.456 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -22.93 67.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.356 -0.84 . . . . 0.0 109.676 178.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 8' ' ' ALA . 0.4 OUTLIER -88.34 -45.08 10.31 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 178.792 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.578 ' HA ' ' CE2' ' A' ' 15' ' ' PHE . 3.8 mm? -56.61 -41.77 77.63 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.578 176.558 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.83 -31.79 72.87 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.15 -44.91 68.15 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.63 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.578 ' CE2' ' HA ' ' A' ' 12' ' ' LEU . 1.1 m-85 -67.1 -24.52 65.94 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.192 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.535 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -67.39 -40.87 85.68 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.176 179.722 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' ND2' ' A' ' 21' ' ' ASN . 20.9 t -77.17 -33.31 20.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 O-C-N 121.352 -0.843 . . . . 0.0 109.394 179.131 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.427 ' O ' ' N ' ' A' ' 21' ' ' ASN . 7.6 m170 -86.49 -63.53 1.3 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.447 -0.783 . . . . 0.0 110.294 179.944 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 t -49.2 -33.5 12.56 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.416 -0.803 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.609 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 7.3 t -85.46 -21.95 28.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.323 -0.861 . . . . 0.0 108.818 178.958 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 24' ' ' GLY . 0.5 OUTLIER -71.15 -17.72 62.53 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.019 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.438 ' C ' ' O ' ' A' ' 21' ' ' ASN . 4.6 t-20 -39.88 -65.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.299 -0.876 . . . . 0.0 110.601 -179.938 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.609 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -53.29 -19.83 3.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.096 -1.002 . . . . 0.0 109.544 179.684 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.569 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -82.46 -34.96 21.47 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.655 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -62.85 -13.95 40.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.987 . . . . 0.0 109.112 178.952 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.475 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.8 mm -91.33 -40.3 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.581 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 24' ' ' GLY . 11.8 mt -48.06 -27.77 2.48 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 176.885 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 2.3 m -50.21 -30.8 12.35 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.968 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.529 ' O ' ' CB ' ' A' ' 30' ' ' THR . 2.4 m -124.19 -69.27 0.82 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 178.883 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.531 ' O ' ' HB3' ' A' ' 31' ' ' ASN . 0.0 OUTLIER 163.73 -65.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.02 0.914 . . . . 0.0 109.345 179.113 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.531 ' HB3' ' O ' ' A' ' 30' ' ' THR . 3.3 p30 175.11 32.01 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.527 ' CB ' ' O ' ' A' ' 31' ' ' ASN . 2.6 t 76.55 48.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 121.299 0.571 . . . . 0.0 109.776 -178.755 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 34' ' ' SER . . . -151.92 41.77 0.72 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.894 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.483 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 56.5 m 56.0 -88.49 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.115 -1.227 . . . . 0.0 110.751 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.515 ' O ' ' N ' ' A' ' 37' ' ' TYR . 0.2 OUTLIER 61.24 156.62 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.164 -0.96 . . . . 0.0 110.023 -179.751 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.4 t -51.06 88.25 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.278 -0.889 . . . . 0.0 110.313 -179.891 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.515 ' N ' ' O ' ' A' ' 35' ' ' ASN . 30.6 p90 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.278 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.234 0.54 . . . . 1.5 110.487 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.5 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 33.7 m -142.72 -111.98 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.371 -0.831 . . . . 1.5 109.834 179.671 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' A' ' 4' ' ' THR . 12.7 t-20 -155.87 15.35 0.35 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.917 -1.114 . . . . 3.2000000000000002 110.376 179.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.582 ' O ' ' CB ' ' A' ' 8' ' ' ALA . 2.3 m 74.42 -82.37 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.126 -0.983 . . . . 2.5 110.17 -179.801 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -46.55 -20.35 0.12 Allowed 'General case' 0 C--N 1.296 -1.728 0 O-C-N 120.691 -1.255 . . . . 2.8999999999999999 108.565 178.114 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 4' ' ' THR . 18.9 m -90.92 -83.33 0.27 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.349 -0.844 . . . . 3.3999999999999999 110.322 179.658 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.5 ' HB2' ' HB2' ' A' ' 2' ' ' CYS . 1.3 m -60.39 -27.11 67.18 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.311 -0.868 . . . . 2.0 109.986 -179.819 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.582 ' CB ' ' O ' ' A' ' 4' ' ' THR . . . -77.54 -47.75 18.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.826 -1.15 . . . . 1.3999999999999999 109.618 179.572 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 30.9 m -66.87 -22.9 65.97 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.626 -1.23 . . . . 1.6000000000000001 108.891 179.017 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.531 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.6 mm-40 -86.44 -16.73 36.23 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.361 -0.837 . . . . 1.6000000000000001 109.259 179.024 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.57 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.23 -44.4 9.24 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.037 -1.838 . . . . 1.3 106.037 178.156 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.527 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 11.1 mt -66.27 -37.76 86.23 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.508 -1.224 . . . . 2.1000000000000001 109.188 177.834 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.478 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -70.94 -29.12 65.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 1.5 109.059 178.871 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.6 t-20 -60.66 -45.42 94.21 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 108.525 -0.917 . . . . 2.6000000000000001 108.525 179.027 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.57 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 3.0 m-85 -68.0 -20.49 65.03 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.893 -1.151 . . . . 2.1000000000000001 107.893 178.379 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.538 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.9 tp -60.0 -46.97 87.72 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.8 -0.76 . . . . 2.2999999999999998 109.334 179.302 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.1 -45.71 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.439 -0.788 . . . . 6.2000000000000002 110.454 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 7.2 m170 -64.14 -44.95 90.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.379 -0.825 . . . . 4.2000000000000002 110.766 -179.432 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -78.31 -40.42 36.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.243 -0.91 . . . . 9.0999999999999996 110.64 -179.397 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.9 t -46.45 -40.51 12.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 10.0 110.588 -179.688 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -90.4 -35.9 14.91 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.221 -0.924 . . . . 7.7000000000000002 111.402 -179.119 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.474 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.9 OUTLIER -78.39 -50.39 11.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.047 -1.033 . . . . 9.0999999999999996 110.783 -179.328 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.472 ' HB3' ' O ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -60.28 -21.83 62.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.304 -0.872 . . . . 9.0999999999999996 110.207 -179.611 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.85 -23.66 32.33 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.61 -1.396 . . . . 7.0999999999999996 109.61 -179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.435 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -74.16 -24.29 59.38 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -1.14 . . . . 25.0 110.363 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ILE . . . . . 0.593 ' N ' ' CD1' ' A' ' 26' ' ' ILE . 1.8 mm -91.95 -44.84 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 107.921 -1.14 . . . . 5.9000000000000004 107.921 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.518 ' N ' HD21 ' A' ' 27' ' ' LEU . 1.4 mm? -51.82 -23.76 5.17 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.115 -1.439 . . . . 5.9000000000000004 107.115 176.206 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.436 ' N ' ' C ' ' A' ' 26' ' ' ILE . 5.4 m -73.61 -5.15 38.54 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.349 -0.841 . . . . 30.0 110.152 179.237 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.8 m -168.41 62.43 0.06 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.17 -0.957 . . . . 16.699999999999999 110.661 -179.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.524 ' O ' ' HB3' ' A' ' 31' ' ' ASN . 1.5 t -123.33 -49.38 1.93 Allowed 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.381 -0.824 . . . . 11.1 109.587 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.544 ' O ' ' CG2' ' A' ' 32' ' ' VAL . 41.9 p-10 173.55 -24.63 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 116.035 -0.53 . . . . 16.699999999999999 110.082 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.544 ' CG2' ' O ' ' A' ' 31' ' ' ASN . 2.1 m 44.69 25.97 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.318 -0.863 . . . . 16.699999999999999 109.247 -178.905 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 31' ' ' ASN . . . 88.77 106.07 1.04 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.179 -1.568 . . . . 16.699999999999999 109.179 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -149.13 -36.51 0.17 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.028 -1.278 . . . . 12.5 110.911 -179.633 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -125.54 177.68 6.07 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 20.0 110.595 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 p -78.9 91.49 4.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.282 -0.886 . . . . 30.0 110.149 -179.987 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 18.3 p90 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 118.013 -0.994 . . . . 30.0 110.222 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.767 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.3 p . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.592 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -49.54 -18.5 0.43 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 120.35 -1.469 . . . . 0.0 108.112 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.489 ' N ' ' C ' ' A' ' 4' ' ' THR . 74.8 m -92.44 -71.42 0.65 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.385 -0.822 . . . . 0.0 110.04 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -34.56 76.16 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.553 -0.717 . . . . 0.0 109.225 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.79 -56.11 11.9 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.37 -0.932 . . . . 0.0 109.535 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.554 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 42.0 p -55.61 -27.66 50.73 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.036 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -33.0 71.81 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.488 -0.757 . . . . 0.0 110.068 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 tpp180 -87.38 -44.61 11.24 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.529 ' HB2' ' HA ' ' A' ' 9' ' ' THR . 6.6 mp -54.92 -34.05 62.78 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.598 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.65 -30.69 68.45 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.764 0.793 . . . . 0.0 109.241 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.13 -40.89 82.43 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.405 -0.81 . . . . 0.0 109.269 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.533 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.4 m-85 -83.64 -16.11 46.39 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.565 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 mt -68.39 -49.7 58.2 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.421 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 22.7 t -76.32 -25.51 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.426 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -89.44 -57.94 2.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.214 -0.929 . . . . 0.0 110.629 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.6 t -54.92 -33.43 62.13 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.416 -0.802 . . . . 0.0 111.852 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 O-C-N 120.763 -1.211 . . . . 0.0 111.532 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.594 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.7 m . . . . . 0 C--O 1.213 -0.84 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -34.98 -25.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 120.908 0.385 . . . . 0.0 110.985 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.594 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.0 t -74.0 -40.21 63.09 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 120.946 -1.096 . . . . 0.0 109.479 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' N ' ' O ' ' A' ' 4' ' ' THR . 21.2 t -74.42 -59.77 2.58 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.209 -0.932 . . . . 0.0 109.387 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.605 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -49.89 -46.78 52.09 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.969 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.508 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 6.8 m -57.31 -43.65 83.47 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.165 -0.959 . . . . 0.0 109.184 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.443 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -64.24 -25.38 68.04 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.399 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.11 -43.01 11.37 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.605 HD23 ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -61.38 -30.38 70.5 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.88 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.608 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -68.22 -37.8 81.23 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.755 0.788 . . . . 0.0 109.279 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -41.33 85.42 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.651 -0.656 . . . . 0.0 109.526 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -79.92 -22.05 43.19 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.636 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -60.3 -36.71 78.5 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.164 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.0 t -90.49 -33.36 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.774 . . . . 0.0 109.952 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -80.89 -36.85 30.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.277 -0.89 . . . . 0.0 110.338 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 22.8 t -90.13 -40.45 12.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.118 -0.989 . . . . 0.0 112.302 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.498 1.94 0 O-C-N 120.809 -1.182 . . . . 0.0 112.892 -177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.846 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.2 p . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.521 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -46.12 -24.8 0.49 Allowed 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 118.299 -1.36 . . . . 0.0 107.918 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.497 HG22 ' N ' ' A' ' 7' ' ' CYS . 4.3 m -92.71 -76.79 0.46 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.581 -0.699 . . . . 0.0 109.812 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' N ' HG22 ' A' ' 6' ' ' THR . 10.9 m -60.16 -40.47 89.99 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.571 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.846 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -64.61 -48.72 73.86 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 118.886 -1.126 . . . . 0.0 108.919 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.3 m -51.15 -41.85 60.39 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 118.432 -1.307 . . . . 0.0 108.049 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ASN . 3.1 tp-100 -65.52 -21.68 66.64 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 121.446 -0.784 . . . . 0.0 110.661 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.588 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.08 -50.87 5.61 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 179.201 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -42.18 98.54 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.762 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -68.77 -27.52 65.97 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.7 t30 -55.9 -41.11 74.01 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.588 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 2.2 m-85 -88.96 -16.92 30.58 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 tp -72.38 -41.42 66.35 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.354 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -86.17 -27.48 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.858 . . . . 0.0 109.738 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 12.7 m170 -84.06 -49.49 8.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.278 -0.889 . . . . 0.0 109.928 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 p -71.01 -24.54 62.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.302 -0.874 . . . . 0.0 110.645 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 11.3 t . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.106 -0.996 . . . . 0.0 110.394 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.642 ' HB ' HG22 ' A' ' 6' ' ' THR . 75.9 p . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.468 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -42.23 -22.49 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.494 -0.754 . . . . 0.0 109.86 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.642 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.8 t -77.79 -29.3 50.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.0 109.884 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.9 t -89.31 -63.69 1.25 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.189 -0.944 . . . . 0.0 109.634 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.466 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -44.58 -51.49 8.94 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.355 -0.841 . . . . 0.0 108.995 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 99.0 m -57.65 -48.06 80.52 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.199 -0.938 . . . . 0.0 109.342 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 6' ' ' THR . 3.0 tp60 -67.77 -17.41 64.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.243 -0.911 . . . . 0.0 110.63 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.468 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 3.2 ttm180 -91.19 -43.24 9.97 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 3.9 mm? -66.2 -37.08 84.74 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.189 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.26 -29.54 66.35 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.541 -0.724 . . . . 0.0 109.192 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -60.78 -43.83 97.57 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.918 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.608 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.97 -23.56 31.0 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -58.71 -58.33 9.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.396 -0.815 . . . . 0.0 109.862 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.1 -32.53 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.373 -0.83 . . . . 0.0 110.299 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.475 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.8 m170 -81.47 -68.16 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.19 -0.944 . . . . 0.0 110.288 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 8.5 t -39.32 -40.17 0.75 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.004 -0.678 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 C--N 1.297 -1.707 0 O-C-N 120.951 -1.093 . . . . 0.0 109.969 179.931 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.8 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -44.93 -22.05 0.08 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.534 -1.354 . . . . 0.0 108.748 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.523 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -91.4 -75.29 0.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.328 -0.858 . . . . 0.0 110.941 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HB2' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -63.19 -25.9 68.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.912 -1.117 . . . . 0.0 109.49 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.8 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -70.65 -56.99 5.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.741 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 44.5 p -56.58 -28.27 59.87 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.386 -1.326 . . . . 0.0 107.902 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 33.5 mm-40 -78.28 -22.15 48.68 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.553 0.692 . . . . 0.0 109.616 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.07 -42.04 13.37 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.621 HD23 ' O ' ' A' ' 8' ' ' ALA . 3.7 mm? -57.3 -45.05 84.52 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.55 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.9 -22.28 65.09 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -63.88 -45.31 89.97 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.589 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 9.0 m-85 -65.94 -23.41 66.6 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -55.35 -40.27 71.06 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.9 t -85.65 -44.97 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 120.109 -0.637 . . . . 0.0 109.955 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.435 ' HB2' ' HA ' ' A' ' 15' ' ' PHE . 21.9 m-70 -66.84 -50.03 63.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.217 -0.927 . . . . 0.0 109.693 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.2 t -55.51 -53.34 57.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 0.0 109.711 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.374 -0.828 . . . . 0.0 109.9 179.682 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.611 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -40.41 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.651 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.611 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.7 t -67.36 -39.13 85.68 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 108.782 178.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.6 t -79.25 -47.61 15.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.25 77.37 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 18.7 m -56.14 -39.61 72.53 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.6 tp60 -69.1 -19.25 64.05 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.65 0.738 . . . . 0.0 109.418 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 1.7 mmm180 -87.61 -51.28 5.98 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 105.264 -2.124 . . . . 0.0 105.264 177.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.918 ' O ' HD13 ' A' ' 16' ' ' LEU . 10.6 mt -56.08 -29.94 61.29 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.648 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.78 -26.1 62.29 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 30.6 t-20 -58.94 -46.76 87.19 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CB ' ' A' ' 19' ' ' SER . 2.1 m-85 -76.94 -21.18 55.19 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.918 HD13 ' O ' ' A' ' 12' ' ' LEU . 4.9 mp -67.33 -67.58 0.44 Allowed 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.176 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 71.8 t -58.63 -26.31 30.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 110.445 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 48.2 m80 -88.56 -52.8 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.187 -0.946 . . . . 0.0 111.298 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.0 p -68.81 -32.62 72.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.281 -0.887 . . . . 0.0 110.145 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 59.7 m . . . . . 0 N--CA 1.489 1.518 0 O-C-N 120.997 -1.065 . . . . 0.0 109.1 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.548 ' CB ' HG22 ' A' ' 6' ' ' THR . 14.7 p . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.499 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -39.88 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.679 -0.638 . . . . 0.0 109.555 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.548 HG22 ' CB ' ' A' ' 4' ' ' THR . 6.1 t -64.37 -42.45 96.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' CG2' ' A' ' 6' ' ' THR . 5.3 t -84.12 -42.99 15.46 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.461 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -60.82 -53.38 58.06 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.499 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 85.3 m -55.55 -38.59 69.5 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.875 -1.13 . . . . 0.0 108.147 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -71.13 -21.26 62.22 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.846 0.832 . . . . 0.0 109.394 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -87.01 -43.03 12.65 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' O ' HD23 ' A' ' 16' ' ' LEU . 2.3 mm? -57.57 -39.57 77.03 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.791 176.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.82 -28.34 67.48 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.63 -43.32 97.65 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.507 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -75.81 -17.85 59.7 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.045 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.7 OUTLIER -67.11 -38.66 86.01 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.591 -0.844 . . . . 0.0 108.978 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -86.41 -29.2 5.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.592 -0.692 . . . . 0.0 109.335 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -85.1 -51.56 6.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.369 -0.832 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.3 p -68.81 -39.92 79.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.812 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 7.8 t . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.192 -0.943 . . . . 0.0 110.037 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.539 ' CG2' HG22 ' A' ' 6' ' ' THR . 3.0 m . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.514 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.53 -24.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.264 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.576 HG23 ' N ' ' A' ' 7' ' ' CYS . 14.9 t -74.61 -40.77 61.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.211 -0.931 . . . . 0.0 109.372 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.576 ' N ' HG23 ' A' ' 6' ' ' THR . 9.4 t -77.31 -57.79 3.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.423 -0.798 . . . . 0.0 109.829 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.83 -46.27 51.0 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.385 -0.822 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 22.1 m -64.77 -44.16 90.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.818 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.5 tp60 -78.15 -10.95 59.87 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.362 -0.836 . . . . 0.0 111.122 -179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.6 OUTLIER -91.38 -51.72 5.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 7.5 mt -58.51 -45.22 89.24 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.869 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.455 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . . . -64.52 -27.4 68.94 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 11' ' ' ARG . 20.1 t-20 -53.36 -46.92 69.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -90.68 -20.14 22.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.535 -0.728 . . . . 0.0 109.07 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -70.68 -40.4 72.95 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.507 -0.877 . . . . 0.0 109.629 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.1 t -84.64 -29.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.303 -0.873 . . . . 0.0 109.619 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 9.9 m170 -85.86 -47.52 9.61 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.465 -0.772 . . . . 0.0 110.924 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -78.22 -22.95 47.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.244 -0.91 . . . . 0.0 111.692 -178.555 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 4.2 p . . . . . 0 N--CA 1.491 1.611 0 O-C-N 120.592 -1.318 . . . . 0.0 111.423 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.908 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.5 m . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 120.557 0.218 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.542 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . -43.86 -21.92 0.05 OUTLIER 'General case' 0 C--N 1.295 -1.796 0 O-C-N 120.818 -1.176 . . . . 0.0 109.542 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.7 p -91.47 -85.84 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.134 -0.979 . . . . 0.0 110.595 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 6' ' ' THR . 2.1 m -55.82 -30.45 61.42 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.538 -0.726 . . . . 0.0 109.625 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.908 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -74.63 -58.9 2.99 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.114 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.816 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 1.5 t -50.67 -27.15 6.42 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 118.347 -1.341 . . . . 0.0 109.623 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -70.75 -35.71 72.78 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 14.4 ttp180 -88.21 -39.73 14.25 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.1 mm? -64.24 -25.99 68.31 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.077 176.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.816 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -67.56 -43.18 81.28 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 121.725 0.774 . . . . 0.0 109.719 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.554 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 40.7 t30 -56.32 -42.66 78.01 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.561 0.696 . . . . 0.0 109.639 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -86.65 -12.98 46.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.636 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -69.5 -40.4 77.02 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.284 -0.966 . . . . 0.0 108.967 179.226 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.3 t -80.73 -33.06 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.297 -0.877 . . . . 0.0 109.256 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -81.97 -48.78 11.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.462 -0.774 . . . . 0.0 110.495 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.6 t -70.75 -50.4 36.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.212 -0.93 . . . . 0.0 110.794 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 3.4 t . . . . . 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.329 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -38.73 -28.98 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.51 0.672 . . . . 0.0 109.689 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 4' ' ' THR . 9.4 t -67.01 -44.91 79.1 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.629 ' N ' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -72.25 -39.08 68.71 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.097 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -62.45 -53.51 53.73 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 18.2 m -57.39 -33.81 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.8 -27.73 66.13 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.47 -0.769 . . . . 0.0 109.803 179.273 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -87.56 -47.12 8.96 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -58.99 -22.57 60.76 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.146 176.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 16' ' ' LEU . . . -73.53 -37.71 65.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.885 0.85 . . . . 0.0 109.287 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -57.82 -42.5 84.43 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.582 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -81.64 -17.22 48.88 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.804 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 13' ' ' ALA . 5.6 mt -66.04 -61.04 2.26 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.85 -1.14 . . . . 0.0 108.508 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -56.34 -41.98 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.773 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -72.84 -56.67 4.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.39 -0.819 . . . . 0.0 110.528 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.571 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.4 t -65.6 -50.52 64.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.291 -0.88 . . . . 0.0 110.618 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 70.7 m . . . . . 0 N--CA 1.493 1.709 0 O-C-N 121.097 -1.002 . . . . 0.0 109.428 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.53 ' O ' ' N ' ' A' ' 7' ' ' CYS . 3.1 m . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.57 -27.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.337 0.589 . . . . 0.0 109.816 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.555 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 5.2 t -67.72 -45.08 76.09 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.219 -0.925 . . . . 0.0 108.619 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' CG2' ' A' ' 6' ' ' THR . 38.9 t -76.53 -49.97 15.11 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.318 -0.864 . . . . 0.0 108.733 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.479 ' O ' HD13 ' A' ' 12' ' ' LEU . . . -51.62 -51.07 58.6 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.478 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.7 m -59.71 -45.97 90.51 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.426 -0.796 . . . . 0.0 108.952 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.535 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -69.63 -13.17 62.17 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.155 -0.966 . . . . 0.0 109.96 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -91.1 -52.85 4.63 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 8' ' ' ALA . 4.1 mp -52.0 -42.43 63.0 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.61 -31.17 72.25 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.19 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 3.7 t-20 -53.26 -52.67 58.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.45 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 2.6 m-85 -60.92 -22.03 63.97 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.25 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.553 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.6 tp -75.77 -38.66 58.15 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.696 0.76 . . . . 0.0 109.149 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 13' ' ' ALA . 17.7 t -88.32 -36.35 9.11 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.235 -0.915 . . . . 0.0 109.366 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.4 m-70 -74.65 -52.85 10.57 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.13 -0.981 . . . . 0.0 111.153 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.93 -31.37 15.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.245 -0.909 . . . . 0.0 112.273 -178.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.75 0 O-C-N 120.746 -1.221 . . . . 0.0 112.648 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.643 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.1 OUTLIER . . . . . 0 C--O 1.21 -0.978 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -41.61 -23.32 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.5 t -72.32 -39.88 67.87 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 4' ' ' THR . 43.6 t -70.03 -40.26 75.29 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.75 -48.41 63.8 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.621 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 5.5 m -57.71 -32.63 67.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 35.0 tt0 -69.26 -25.19 64.14 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.74 0.781 . . . . 0.0 109.687 179.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -88.64 -53.55 4.58 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.288 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -50.3 -37.83 38.37 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 175.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.621 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -63.72 -31.45 72.62 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -50.98 -44.55 60.81 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.2 m-85 -91.59 -26.79 18.55 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -70.75 -43.87 67.93 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 118.619 -1.232 . . . . 0.0 108.693 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.9 t -73.51 -31.64 33.56 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.256 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 0.4 OUTLIER -85.18 -36.56 20.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.416 -0.803 . . . . 0.0 110.693 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.5 t -89.4 -20.36 24.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.182 -0.949 . . . . 0.0 111.416 -178.749 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 20.2 m . . . . . 0 N--CA 1.495 1.794 0 O-C-N 120.758 -1.214 . . . . 0.0 110.641 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.75 ' CG2' HG22 ' A' ' 6' ' ' THR . 2.5 m . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.69 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.75 HG22 ' CG2' ' A' ' 4' ' ' THR . 8.9 t -73.76 -40.27 63.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.519 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.606 ' N ' HG23 ' A' ' 6' ' ' THR . 7.0 t -72.31 -54.42 9.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.608 -0.682 . . . . 0.0 109.91 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.22 -36.6 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 109.357 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 40.9 m -73.43 -42.98 61.35 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.404 -0.81 . . . . 0.0 109.381 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' ' 7' ' ' CYS . 8.2 pt20 -83.28 -5.26 59.07 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 121.362 -0.836 . . . . 0.0 110.472 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.527 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -90.43 -51.71 5.28 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -63.47 -49.33 74.06 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.035 176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.498 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.15 -21.79 65.34 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.527 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 4.1 t-20 -55.98 -59.59 4.69 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.6 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -57.26 -22.95 45.04 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.658 -1.217 . . . . 0.0 108.036 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -74.72 -41.24 60.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.64 -0.824 . . . . 0.0 109.28 179.117 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.9 t -90.33 -42.81 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.212 -0.93 . . . . 0.0 110.033 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.514 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 16.3 m80 -67.67 -36.94 81.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.427 -0.796 . . . . 0.0 110.843 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -90.17 -42.64 10.94 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.348 -178.286 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.296 -1.737 0 O-C-N 121.02 -1.05 . . . . 0.0 112.9 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.64 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -42.6 -16.59 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.316 -0.865 . . . . 0.0 111.365 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.64 HG22 ' HB ' ' A' ' 4' ' ' THR . 3.3 t -87.33 -30.41 20.85 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.027 -1.046 . . . . 0.0 108.285 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 11.8 p -85.12 -38.13 19.43 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -64.69 -46.92 80.34 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.3 p -58.79 -42.11 88.29 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 6' ' ' THR . 15.3 mm100 -75.57 -13.93 60.37 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 121.507 0.67 . . . . 0.0 109.804 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 12.4 tpp180 -90.12 -43.09 10.7 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -62.27 -44.54 96.3 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.557 -1.201 . . . . 0.0 108.767 177.183 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.57 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.7 -25.6 67.39 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.57 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t30 -58.79 -44.35 90.7 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.89 -19.59 34.51 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.3 tp -71.87 -63.9 1.04 Allowed 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.218 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.44 -25.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.045 . . . . 0.0 109.697 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.521 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 18.3 m80 -86.66 -53.03 5.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.251 -0.906 . . . . 0.0 110.648 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -79.56 -25.12 41.69 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.268 -0.895 . . . . 0.0 111.278 -178.897 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.6 t . . . . . 0 N--CA 1.494 1.761 0 O-C-N 121.02 -1.05 . . . . 0.0 110.847 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.714 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.525 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.93 -21.29 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.714 HG22 ' OG1' ' A' ' 4' ' ' THR . 7.2 t -75.6 -37.74 59.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.093 -1.005 . . . . 0.0 109.644 179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.535 ' H ' HG23 ' A' ' 4' ' ' THR . 36.0 t -83.15 -62.52 1.57 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.747 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -43.22 -63.33 0.83 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.124 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.535 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 91.9 m -48.5 -42.05 31.74 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.793 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.541 ' HB2' ' O ' ' A' ' 6' ' ' THR . 41.7 tt0 -61.07 -31.6 71.26 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 121.044 -1.035 . . . . 0.0 110.949 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' CG ' ' CZ ' ' A' ' 15' ' ' PHE . 17.3 ttp85 -92.2 -44.98 8.48 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.833 -1.167 . . . . 0.0 107.853 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 5.5 mp -61.83 -45.77 92.39 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.538 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.74 -28.67 68.6 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t-20 -54.04 -42.61 69.4 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.32 -18.31 28.76 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.657 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 6.7 tp -71.76 -36.57 70.44 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.444 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 t -87.83 -35.52 8.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.166 -0.959 . . . . 0.0 109.347 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 6.9 m-70 -79.29 -48.54 13.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.412 -0.805 . . . . 0.0 111.211 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -90.13 -29.68 18.14 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.917 -1.114 . . . . 0.0 112.287 -178.3 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 O-C-N 120.695 -1.253 . . . . 0.0 111.971 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.651 ' HB ' HG22 ' A' ' 6' ' ' THR . 59.4 p . . . . . 0 N--CA 1.484 1.231 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -40.97 -25.18 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.953 -0.699 . . . . 0.0 109.544 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.651 HG22 ' HB ' ' A' ' 4' ' ' THR . 9.0 t -74.67 -35.73 62.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.412 -0.805 . . . . 0.0 109.91 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.6 t -80.07 -56.64 4.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.435 -0.791 . . . . 0.0 109.823 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -47.17 -62.86 1.22 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.119 -0.988 . . . . 0.0 108.768 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 58.4 p -52.93 -36.83 60.25 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.483 178.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 2.7 mm-40 -60.35 -32.69 71.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.78 -1.2 . . . . 0.0 110.232 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.506 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -91.76 -46.35 7.94 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.703 1.24 . . . . 0.0 107.805 179.784 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 4.9 mp -61.9 -57.47 11.64 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.048 178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 9' ' ' THR . . . -59.17 -26.45 64.78 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.591 ' O ' ' CG ' ' A' ' 18' ' ' HIS . 16.7 t-20 -47.98 -50.19 28.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 19' ' ' SER . 0.7 OUTLIER -92.96 -25.28 18.08 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.548 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.0 -37.96 75.83 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.892 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.442 ' CG2' ' HB1' ' A' ' 13' ' ' ALA . 11.1 t -87.69 -30.69 5.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 O-C-N 121.199 -0.938 . . . . 0.0 109.155 179.113 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.591 ' CG ' ' O ' ' A' ' 14' ' ' ASN . 2.3 m80 -81.4 -47.12 13.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.6 -0.688 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -87.09 -31.81 20.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.128 -0.983 . . . . 0.0 111.7 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.088 . . . . 0.0 111.908 -179.11 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.701 ' HB ' HG22 ' A' ' 6' ' ' THR . 80.5 p . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.661 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -35.56 -30.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.35 0.595 . . . . 0.0 109.843 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.701 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.6 t -57.41 -45.93 84.03 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.584 ' N ' HG23 ' A' ' 6' ' ' THR . 37.9 t -89.14 -45.12 9.83 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.071 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -55.12 -54.3 44.92 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.541 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 28.2 m -57.81 -42.19 83.75 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.152 -0.967 . . . . 0.0 109.025 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 6' ' ' THR . 15.3 mm100 -71.74 -18.22 62.15 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.176 -0.952 . . . . 0.0 109.977 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.573 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -90.49 -49.86 6.27 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 178.757 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.545 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -56.7 -46.43 81.24 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.614 176.81 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -60.35 -32.22 71.06 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.485 0.66 . . . . 0.0 109.268 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 4.8 t-20 -57.88 -44.54 86.74 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.582 -0.699 . . . . 0.0 109.298 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.573 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 1.0 OUTLIER -87.82 -22.78 24.29 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.485 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -72.94 -53.15 12.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.251 -0.979 . . . . 0.0 109.19 179.724 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.49 -29.53 46.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.111 -0.993 . . . . 0.0 109.348 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.481 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 22.6 m170 -86.34 -57.82 2.86 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.351 -0.843 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.8 t -69.41 -26.66 64.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.466 -0.772 . . . . 0.0 111.664 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.7 t . . . . . 0 N--CA 1.492 1.671 0 O-C-N 121.032 -1.042 . . . . 0.0 110.892 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.634 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.4 p . . . . . 0 N--CA 1.481 1.084 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -38.48 -25.34 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.823 -0.548 . . . . 0.0 110.682 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.634 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.5 t -72.61 -33.96 67.05 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.873 -1.142 . . . . 0.0 109.221 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' ' O ' ' A' ' 4' ' ' THR . 36.8 t -89.72 -38.07 14.11 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.271 -0.893 . . . . 0.0 108.807 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.543 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -60.35 -56.5 20.7 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 5' ' ' ALA . 81.5 p -60.14 -38.32 82.75 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.363 -0.935 . . . . 0.0 108.948 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' THR . 4.2 tp60 -73.58 -19.83 60.77 Favored 'General case' 0 N--CA 1.486 1.342 0 O-C-N 121.225 -0.922 . . . . 0.0 110.201 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.0 tpm_? -90.71 -43.06 10.36 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.592 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -60.58 -41.14 94.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.493 177.135 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.593 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.44 -28.35 68.53 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.23 -47.9 77.55 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.592 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 7.0 m-85 -68.31 -21.35 64.77 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.696 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.593 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -64.47 -54.15 37.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.852 . . . . 0.0 109.727 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -72.77 -33.25 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.288 -0.883 . . . . 0.0 110.02 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -79.5 -58.47 3.19 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.138 -0.976 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.569 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 6.7 t -52.99 -22.95 6.32 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.001 -1.062 . . . . 0.0 110.077 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.5 t . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.895 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.583 ' OG1' HG22 ' A' ' 6' ' ' THR . 2.6 t . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 121.688 0.756 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.874 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -39.73 -25.94 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.615 -0.678 . . . . 0.0 109.911 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.583 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.0 t -64.47 -39.8 94.49 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.553 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.2 t -89.72 -32.73 16.87 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.874 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -66.31 -49.38 67.24 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.0 m -59.71 -39.22 83.9 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 6' ' ' THR . 2.6 mt-30 -75.03 -20.01 59.78 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.501 -0.749 . . . . 0.0 109.519 178.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 7' ' ' CYS . 1.4 mmt85 -84.84 -41.93 15.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -59.04 -30.42 68.03 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.198 -1.365 . . . . 0.0 107.973 176.488 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.594 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.64 -35.24 78.53 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 122.003 0.906 . . . . 0.0 108.618 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -58.28 -45.64 87.55 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.1 m-85 -70.54 -19.94 62.85 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.0 OUTLIER -57.67 -32.32 67.2 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.6 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.6 -46.2 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.684 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -69.7 -47.52 62.87 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.177 -0.952 . . . . 0.0 109.824 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.7 t -64.25 -56.14 16.67 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.239 -0.913 . . . . 0.0 109.112 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 82.1 p . . . . . 0 N--CA 1.488 1.45 0 O-C-N 121.228 -0.92 . . . . 0.0 109.083 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.724 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.5 m . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -46.71 -20.9 0.15 Allowed 'General case' 0 C--N 1.293 -1.88 0 O-C-N 120.358 -1.464 . . . . 0.0 108.615 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.1 m -92.49 -65.66 0.98 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.458 -0.776 . . . . 0.0 110.647 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -67.49 -32.87 73.98 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.305 -0.872 . . . . 0.0 108.956 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.31 -55.03 17.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.402 -0.811 . . . . 0.0 109.015 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 79.5 m -57.95 -28.65 64.5 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.596 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 6' ' ' THR . 15.6 mm100 -88.49 -11.25 46.37 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 121.542 -0.724 . . . . 0.0 110.149 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 21.4 ttp180 -89.92 -48.35 7.28 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -61.52 -43.96 97.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.647 -1.16 . . . . 0.0 107.955 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.13 -22.48 66.94 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 21.8 t30 -58.17 -49.36 77.29 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 m-30 -63.82 -24.72 67.86 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -63.1 -49.92 72.53 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.397 179.377 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.2 t -81.46 -31.43 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.441 -0.787 . . . . 0.0 109.942 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -74.08 -57.12 4.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.412 -0.805 . . . . 0.0 110.187 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -69.48 -17.35 63.6 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.995 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 1.2 t . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.166 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.55 -25.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.62 0.724 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.602 HG23 ' N ' ' A' ' 7' ' ' CYS . 8.0 t -78.75 -44.61 22.96 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.498 -0.751 . . . . 0.0 109.525 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.602 ' N ' HG23 ' A' ' 6' ' ' THR . 44.3 t -61.44 -47.16 87.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.463 -0.773 . . . . 0.0 109.185 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.577 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -56.95 -48.84 77.36 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.698 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 13' ' ' ALA . 17.5 m -63.11 -42.48 99.58 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.687 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 6' ' ' THR . 1.0 OUTLIER -66.29 -20.8 66.2 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.477 -0.764 . . . . 0.0 109.804 179.376 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -90.04 -48.87 6.92 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 178.551 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.577 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -58.77 -31.81 68.72 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.825 176.669 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.62 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.39 -27.99 61.77 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.796 0.808 . . . . 0.0 108.998 179.013 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 6.5 t-20 -60.45 -43.19 97.1 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.759 -0.588 . . . . 0.0 109.822 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.16 -16.53 33.13 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.162 179.923 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.3 mt -70.53 -49.29 49.69 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.815 -179.863 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.66 -36.43 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.413 -0.805 . . . . 0.0 109.852 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 10.8 m80 -77.93 -55.78 5.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.455 -0.778 . . . . 0.0 111.279 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -75.76 -36.73 59.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.269 -0.894 . . . . 0.0 112.358 -178.047 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.758 -1.214 . . . . 0.0 112.456 -178.618 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.538 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.52 -23.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.826 -0.546 . . . . 0.0 110.177 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.538 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -77.65 -41.22 39.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.143 -0.973 . . . . 0.0 109.519 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.499 ' N ' HG23 ' A' ' 6' ' ' THR . 38.3 t -86.13 -48.78 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.145 178.951 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -54.1 -53.31 54.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.025 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 52.3 m -54.33 -42.91 70.74 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.719 178.728 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -74.23 -18.81 60.69 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.312 -0.867 . . . . 0.0 110.653 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.3 mmt85 -90.1 -37.88 13.94 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.271 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -68.3 -31.64 71.23 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.276 177.974 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.83 -32.45 67.55 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.758 0.79 . . . . 0.0 108.869 178.82 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 18.0 t30 -59.04 -44.02 91.72 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.424 0.63 . . . . 0.0 109.644 179.314 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -79.78 -16.93 54.6 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.168 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -68.29 -54.9 14.33 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.541 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -78.44 -19.86 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.332 -0.855 . . . . 0.0 110.105 179.652 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 15.1 m170 -88.6 -56.98 3.08 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.036 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.6 p -62.2 -21.03 64.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.432 -0.792 . . . . 0.0 110.587 -179.624 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.075 -1.015 . . . . 0.0 110.37 -179.977 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 6' ' ' THR . 1.5 m . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.467 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.57 -25.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.69 -0.631 . . . . 0.0 110.043 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 4' ' ' THR . 3.0 t -75.48 -34.08 60.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.951 . . . . 0.0 110.368 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.3 t -89.9 -60.86 1.82 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.962 . . . . 0.0 109.641 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.753 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -44.97 -54.37 6.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.867 . . . . 0.0 109.206 179.136 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 27.9 m -59.78 -43.45 94.37 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.458 -0.776 . . . . 0.0 110.076 179.579 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.52 65.1 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 121.187 -0.946 . . . . 0.0 110.555 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.617 ' HG3' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.12 -50.07 6.05 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.114 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.753 HD12 ' C ' ' A' ' 8' ' ' ALA 0.262 3.2 mt -58.27 -39.75 80.07 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.25 178.101 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.8 -34.29 77.82 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.523 -0.736 . . . . 0.0 109.429 179.246 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.507 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 7.4 t30 -56.24 -44.57 79.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.403 -0.81 . . . . 0.0 109.349 179.393 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.621 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -85.44 -20.03 30.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.919 . . . . 0.0 108.877 179.568 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.539 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.0 tp -66.13 -52.71 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.823 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 t -72.1 -30.88 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.163 -0.961 . . . . 0.0 110.29 179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 19.5 m-70 -89.8 -66.71 0.9 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.995 . . . . 0.0 110.878 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.2 t -50.95 -23.69 3.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 111.284 -178.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 9.1 p . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.863 -1.148 . . . . 0.0 111.43 -179.337 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.78 HG22 ' N ' ' A' ' 5' ' ' ALA . 1.8 m . . . . . 0 N--CA 1.512 2.639 0 CA-C-O 120.754 0.312 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.78 ' N ' HG22 ' A' ' 4' ' ' THR . . . -43.53 -22.93 0.05 Allowed 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.567 -1.333 . . . . 0.0 108.995 179.58 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.2 OUTLIER -92.68 -57.96 2.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.569 -0.707 . . . . 0.0 110.907 179.507 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -77.76 -37.34 49.3 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -179.794 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.748 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -62.56 -52.4 63.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.556 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 31.8 m -59.84 -26.42 65.8 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.06 -1.025 . . . . 0.0 109.267 179.136 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -89.96 -17.81 27.22 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.441 -0.787 . . . . 0.0 110.69 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -91.2 -39.44 12.1 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.597 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.604 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 2.0 mt -61.96 -49.04 77.69 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.639 -1.164 . . . . 0.0 108.696 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 16' ' ' LEU . . . -65.31 -27.79 68.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 10' ' ' GLN . 26.4 t-20 -61.38 -46.48 90.01 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 3.9 m-85 -62.71 -21.41 65.76 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 178.159 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.468 ' CB ' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -65.77 -53.76 36.06 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.708 179.336 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -80.24 -24.01 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 109.902 179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -85.63 -62.2 1.58 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.968 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.7 p -51.48 -38.59 54.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.192 -0.943 . . . . 0.0 109.749 179.802 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.488 1.467 0 O-C-N 121.385 -0.822 . . . . 0.0 109.682 179.57 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.576 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.209 -1.036 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 . . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -33.14 -31.24 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.022 0.439 . . . . 0.0 110.416 -179.441 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.588 HG23 ' N ' ' A' ' 7' ' ' CYS . 7.2 t -62.32 -45.56 92.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.035 -1.041 . . . . 0.0 108.426 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.588 ' N ' HG23 ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.69 -55.98 11.1 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.71 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.534 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -50.85 -57.79 7.59 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.014 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.542 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 15.0 m -54.39 -36.45 63.93 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.326 -0.859 . . . . 0.0 109.553 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 34.7 tp60 -65.2 -32.05 73.54 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.297 -0.877 . . . . 0.0 110.319 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 15.0 tpp180 -87.07 -48.0 8.45 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 178.338 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 8' ' ' ALA . 2.1 mt -52.05 -37.57 54.1 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.011 176.541 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -58.42 -43.94 88.86 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.464 0.649 . . . . 0.0 109.586 179.156 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.461 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 2.3 t30 -49.28 -43.55 43.25 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.251 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.558 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 0.4 OUTLIER -90.2 -19.29 24.37 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.451 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -67.97 -36.54 80.24 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.345 -0.942 . . . . 0.0 109.45 -179.919 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.7 t -85.17 -34.26 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.366 -0.833 . . . . 0.0 108.849 178.729 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -78.98 -53.75 6.72 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.482 -0.761 . . . . 0.0 110.004 179.539 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 15.5 t -61.98 -39.62 92.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.907 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 12.9 t . . . . . 0 N--CA 1.488 1.454 0 O-C-N 121.298 -0.876 . . . . 0.0 109.293 179.502 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.852 ' OG1' HG22 ' A' ' 6' ' ' THR . 1.7 t . . . . . 0 C--O 1.207 -1.157 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.401 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -40.06 -17.09 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.799 -0.563 . . . . 0.0 111.597 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.852 HG22 ' OG1' ' A' ' 4' ' ' THR . 8.8 t -77.5 -30.52 53.04 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 120.853 -1.155 . . . . 0.0 108.033 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.611 ' HB3' HG23 ' A' ' 4' ' ' THR . 10.6 p -83.96 -36.3 23.34 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.961 179.249 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.647 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.581 -0.699 . . . . 0.0 109.673 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -75.54 -35.74 60.62 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.082 179.13 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 6' ' ' THR . 4.2 tp-100 -81.04 -19.77 43.11 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.38 -0.825 . . . . 0.0 110.955 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 10.9 tpp180 -87.49 -41.92 13.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 178.94 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 8' ' ' ALA . 2.2 mm? -56.09 -31.57 63.35 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.396 176.649 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.616 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.07 -33.18 73.14 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.766 0.793 . . . . 0.0 109.097 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.09 -47.45 81.01 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.597 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 2.9 m-85 -70.44 -22.78 62.67 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.465 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.5 tp -51.16 -34.02 29.54 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 178.922 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 20' ' ' SER . 86.2 t -90.97 -55.33 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 119.966 -0.694 . . . . 0.0 110.112 179.002 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.8 m170 -61.3 -39.56 90.91 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.23 -0.919 . . . . 0.0 110.391 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -80.61 -31.39 36.67 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.406 -0.809 . . . . 0.0 108.819 179.249 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.04 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.884 ' HB ' HG22 ' A' ' 6' ' ' THR . 2.9 p . . . . . 0 N--CA 1.483 1.212 0 CA-C-O 121.619 0.723 . . . . 0.0 109.228 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -45.22 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.179 -0.951 . . . . 0.0 110.993 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.884 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.0 t -86.06 -28.42 24.12 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.003 -1.061 . . . . 0.0 109.709 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' ALA . 14.8 p -88.67 -36.14 16.39 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.613 -0.68 . . . . 0.0 110.085 -179.455 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -72.85 -61.09 1.93 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.511 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -56.72 -31.99 65.06 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.324 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -76.0 -24.89 55.34 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.784 -1.198 . . . . 0.0 110.591 -179.641 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.6 OUTLIER -91.15 -44.07 9.48 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.641 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -61.96 -43.19 99.35 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.568 178.003 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.512 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.35 -29.86 70.14 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.447 -0.783 . . . . 0.0 109.403 179.263 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.83 -44.02 97.69 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.55 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.0 OUTLIER -72.59 -20.84 61.23 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.787 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -61.76 -39.68 92.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.573 179.489 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -86.1 -44.85 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.787 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -71.66 -51.22 24.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.537 -0.727 . . . . 0.0 110.997 -179.718 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.9 t -67.43 -42.05 83.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.211 -0.931 . . . . 0.0 110.838 -179.411 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 3.3 m . . . . . 0 C--N 1.301 -1.511 0 O-C-N 120.96 -1.087 . . . . 0.0 109.837 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.55 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.604 0.716 . . . . 0.0 109.792 . . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.86 -22.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.307 -0.871 . . . . 0.0 110.923 179.513 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.595 HG23 ' N ' ' A' ' 7' ' ' CYS . 10.0 t -80.44 -38.13 30.68 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.01 -1.056 . . . . 0.0 108.16 179.122 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.595 ' N ' HG23 ' A' ' 6' ' ' THR . 11.7 p -82.18 -37.31 26.3 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.339 179.436 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.508 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -59.54 -64.32 0.99 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.344 -0.848 . . . . 0.0 108.783 178.909 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.2 m -53.05 -39.1 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.442 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 6' ' ' THR . 8.6 tt0 -68.53 -20.72 64.58 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 121.606 -0.683 . . . . 0.0 109.705 179.203 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 5.6 tpm_? -89.76 -49.15 6.8 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 105.769 -1.937 . . . . 0.0 105.769 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.2 mp -54.79 -35.93 64.37 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.36 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.95 -27.18 64.53 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.9 t-20 -58.75 -45.55 89.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.671 -0.643 . . . . 0.0 109.565 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.584 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 1.5 m-85 -77.64 -17.49 57.7 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.031 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 tp -66.99 -48.27 68.96 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.433 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.2 t -87.03 -35.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.0 109.983 179.457 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 26.5 m170 -67.48 -49.42 63.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.154 -0.966 . . . . 0.0 110.048 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 8.9 t -73.68 -25.91 60.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -0.872 . . . . 0.0 110.385 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 39.2 t . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.0 110.346 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.615 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 121.34 0.591 . . . . 0.0 109.411 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.557 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.28 -27.47 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 CA-C-O 121.108 0.48 . . . . 0.0 110.003 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.615 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.6 t -62.1 -39.33 92.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.979 . . . . 0.0 108.709 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.9 t -86.49 -48.6 8.25 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.673 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -57.45 -56.69 18.59 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.547 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.557 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 88.8 m -48.75 -44.21 38.41 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.821 -1.152 . . . . 0.0 108.224 178.456 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -63.01 -22.93 67.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.356 -0.84 . . . . 0.0 109.676 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 8' ' ' ALA . 0.4 OUTLIER -88.34 -45.08 10.31 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 178.792 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.579 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 3.8 mm? -56.61 -41.77 77.63 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.578 176.558 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.83 -31.79 72.87 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.783 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -53.15 -44.91 68.15 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.63 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.579 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 1.1 m-85 -67.1 -24.52 65.94 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.192 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -67.39 -40.87 85.68 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.176 179.722 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.9 t -77.17 -33.31 20.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 O-C-N 121.352 -0.843 . . . . 0.0 109.394 179.131 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -86.49 -63.53 1.3 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.447 -0.783 . . . . 0.0 110.294 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 t -49.2 -33.5 12.56 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.416 -0.803 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 7.3 t . . . . . 0 C--N 1.303 -1.424 0 O-C-N 121.323 -0.861 . . . . 0.0 108.818 178.958 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.864 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 m . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 110.17 -0.307 . . . . 2.5 110.17 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.487 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -46.55 -20.35 0.12 Allowed 'General case' 0 C--N 1.296 -1.728 0 O-C-N 120.691 -1.255 . . . . 2.8999999999999999 108.565 178.114 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 4' ' ' THR . 18.9 m -90.92 -83.33 0.27 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.349 -0.844 . . . . 3.3999999999999999 110.322 179.658 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.496 ' N ' HG22 ' A' ' 6' ' ' THR . 1.3 m -60.39 -27.11 67.18 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.311 -0.868 . . . . 2.0 109.986 -179.819 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.864 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -77.54 -47.75 18.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.826 -1.15 . . . . 1.3999999999999999 109.618 179.572 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 30.9 m -66.87 -22.9 65.97 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.626 -1.23 . . . . 1.6000000000000001 108.891 179.017 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -86.44 -16.73 36.23 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.361 -0.837 . . . . 1.6000000000000001 109.259 179.024 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.57 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.23 -44.4 9.24 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.037 -1.838 . . . . 1.3 106.037 178.156 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 11.1 mt -66.27 -37.76 86.23 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.508 -1.224 . . . . 2.1000000000000001 109.188 177.834 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.94 -29.12 65.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 1.5 109.059 178.871 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.6 t-20 -60.66 -45.42 94.21 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 108.525 -0.917 . . . . 2.6000000000000001 108.525 179.027 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.57 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 3.0 m-85 -68.0 -20.49 65.03 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.893 -1.151 . . . . 2.1000000000000001 107.893 178.379 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.538 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.9 tp -60.0 -46.97 87.72 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.8 -0.76 . . . . 2.2999999999999998 109.334 179.302 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.1 -45.71 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.439 -0.788 . . . . 6.2000000000000002 110.454 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 7.2 m170 -64.14 -44.95 90.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.379 -0.825 . . . . 4.2000000000000002 110.766 -179.432 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -78.31 -40.42 36.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.243 -0.91 . . . . 9.0999999999999996 110.64 -179.397 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.9 t . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 10.0 110.588 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.192 0.52 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.444 ' HB2' ' H ' ' A' ' 7' ' ' CYS . 56.2 m -86.69 -82.48 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.079 -1.013 . . . . 0.0 109.457 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.754 ' C ' HG23 ' A' ' 4' ' ' THR . 16.4 t-20 -154.64 17.65 0.46 Allowed 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.417 -0.802 . . . . 0.0 109.426 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.767 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.3 p 75.88 -86.64 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.567 -0.708 . . . . 0.0 109.425 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.592 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -49.54 -18.5 0.43 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 120.35 -1.469 . . . . 0.0 108.112 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.489 ' N ' ' C ' ' A' ' 4' ' ' THR . 74.8 m -92.44 -71.42 0.65 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.385 -0.822 . . . . 0.0 110.04 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.444 ' H ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -61.82 -34.56 76.16 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.553 -0.717 . . . . 0.0 109.225 179.695 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.79 -56.11 11.9 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.37 -0.932 . . . . 0.0 109.535 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.554 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 42.0 p -55.61 -27.66 50.73 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.036 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -33.0 71.81 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.488 -0.757 . . . . 0.0 110.068 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 tpp180 -87.38 -44.61 11.24 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.529 ' HB2' ' HA ' ' A' ' 9' ' ' THR . 6.6 mp -54.92 -34.05 62.78 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.598 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.65 -30.69 68.45 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.764 0.793 . . . . 0.0 109.241 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.13 -40.89 82.43 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.405 -0.81 . . . . 0.0 109.269 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.533 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.4 m-85 -83.64 -16.11 46.39 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.565 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 mt -68.39 -49.7 58.2 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.421 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.466 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 22.7 t -76.32 -25.51 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.426 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 6.0 m170 -89.44 -57.94 2.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.214 -0.929 . . . . 0.0 110.629 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.6 t -54.92 -33.43 62.13 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.416 -0.802 . . . . 0.0 111.852 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -90.73 -34.92 15.18 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.763 -1.211 . . . . 0.0 111.532 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.466 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 57.6 t30 -78.71 -46.29 19.36 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.921 -1.112 . . . . 0.0 111.246 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.526 ' O ' HG12 ' A' ' 26' ' ' ILE . 1.0 OUTLIER -43.9 -24.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.217 -0.927 . . . . 0.0 111.026 -179.099 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.413 ' N ' ' O ' ' A' ' 21' ' ' ASN . 2.1 m-85 -66.29 -53.61 34.62 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.104 -0.998 . . . . 0.0 110.718 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.418 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -59.41 -19.42 47.29 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.302 -1.919 . . . . 0.0 108.302 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.759 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -78.77 -24.54 44.65 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.421 -1.047 . . . . 0.0 111.428 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.901 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.2 mm -90.91 -51.35 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.533 ' HA ' HD13 ' A' ' 27' ' ' LEU 0.255 2.6 mm? -49.89 -25.44 3.2 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 176.094 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.422 ' N ' ' C ' ' A' ' 26' ' ' ILE . 2.2 m -78.39 2.59 18.22 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.242 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.431 ' N ' ' O ' ' A' ' 26' ' ' ILE . 2.5 t -132.82 42.32 3.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.96 -1.088 . . . . 0.0 110.895 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -121.13 -73.97 0.63 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.284 -0.885 . . . . 0.0 109.074 179.424 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.575 ' ND2' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -73.51 -2.23 21.82 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.971 -0.692 . . . . 0.0 109.17 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.6 p -45.26 -20.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.173 -0.954 . . . . 0.0 110.088 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . -115.62 -22.88 4.58 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 33' ' ' GLY . 1.3 m 67.28 -61.16 0.36 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.254 -1.145 . . . . 0.0 109.883 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.514 ' N ' ' O ' ' A' ' 33' ' ' GLY . 2.6 t-20 -67.93 -170.68 0.18 Allowed 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.496 -0.753 . . . . 0.0 109.81 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 m -63.08 102.22 0.35 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.924 . . . . 0.0 110.042 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.072 -0.965 . . . . 0.0 110.3 -179.889 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 12.0 mttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.337 0.589 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 18.7 m -156.68 -101.56 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -0.906 . . . . 0.0 110.249 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 12.0 t-20 175.5 34.85 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.594 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.7 m -169.48 105.17 0.36 Allowed 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -34.98 -25.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 120.908 0.385 . . . . 0.0 110.985 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.594 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.0 t -74.0 -40.21 63.09 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 120.946 -1.096 . . . . 0.0 109.479 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' N ' ' O ' ' A' ' 4' ' ' THR . 21.2 t -74.42 -59.77 2.58 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.209 -0.932 . . . . 0.0 109.387 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.605 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -49.89 -46.78 52.09 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.969 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.508 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 6.8 m -57.31 -43.65 83.47 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.165 -0.959 . . . . 0.0 109.184 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.443 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -64.24 -25.38 68.04 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.399 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.11 -43.01 11.37 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.605 HD23 ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -61.38 -30.38 70.5 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.88 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.608 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -68.22 -37.8 81.23 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.755 0.788 . . . . 0.0 109.279 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -41.33 85.42 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.651 -0.656 . . . . 0.0 109.526 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -79.92 -22.05 43.19 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.636 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -60.3 -36.71 78.5 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.164 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.521 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 78.0 t -90.49 -33.36 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.774 . . . . 0.0 109.952 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -80.89 -36.85 30.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.277 -0.89 . . . . 0.0 110.338 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 22.8 t -90.13 -40.45 12.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.118 -0.989 . . . . 0.0 112.302 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.48 ' O ' ' CE1' ' A' ' 23' ' ' PHE . 1.0 OUTLIER -91.2 -20.96 21.39 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.809 -1.182 . . . . 0.0 112.892 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 1.1 t-20 -88.74 -9.42 51.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.571 -1.331 . . . . 0.0 111.653 -178.48 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -57.31 -75.7 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.918 -1.113 . . . . 0.0 110.068 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 20' ' ' SER . 19.6 p90 -54.24 -28.09 39.03 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.092 -1.005 . . . . 0.0 109.024 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.26 -32.43 65.37 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 108.511 -1.836 . . . . 0.0 108.511 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.671 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -66.08 -16.55 64.03 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.419 -1.047 . . . . 0.0 109.448 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.842 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -89.29 -49.19 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.471 ' HA ' HD13 ' A' ' 27' ' ' LEU 0.255 3.7 mm? -61.66 -16.29 47.47 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.345 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.485 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.9 m -67.91 -36.77 80.75 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.288 0.566 . . . . 0.0 110.378 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.748 ' O ' HG22 ' A' ' 30' ' ' THR . 0.6 OUTLIER -86.53 -58.07 2.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.304 -0.873 . . . . 0.0 110.494 -179.725 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.748 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 81.59 -35.13 0.1 Allowed 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 121.153 0.502 . . . . 0.0 110.855 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -66.45 -7.06 17.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.164 -0.96 . . . . 0.0 109.68 179.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.6 t -124.31 -15.35 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.479 -0.763 . . . . 0.0 110.335 -179.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.42 59.49 0.42 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 30' ' ' THR . 67.4 p -121.01 -86.59 0.65 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -1.137 . . . . 0.0 109.925 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.449 ' O ' ' OG1' ' A' ' 36' ' ' THR . 10.0 m-80 -149.45 129.55 13.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.285 -0.885 . . . . 0.0 110.151 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 35' ' ' ASN . 10.4 p 43.15 77.18 0.07 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.398 -0.814 . . . . 0.0 110.266 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 p90 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.294 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.467 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 3.0 mtmp? . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.119 0.485 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.467 ' SG ' ' O ' ' A' ' 1' ' ' LYS . 35.5 m -155.96 96.83 1.76 Allowed 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.44 -0.788 . . . . 0.0 109.432 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.499 ' O ' ' OG1' ' A' ' 4' ' ' THR . 48.5 t30 -89.35 27.07 1.51 Allowed 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.388 -0.82 . . . . 0.0 109.119 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.846 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.2 p 63.01 -71.0 0.06 Allowed 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.971 -0.455 . . . . 0.0 109.935 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.521 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -46.12 -24.8 0.49 Allowed 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 118.299 -1.36 . . . . 0.0 107.918 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.497 HG22 ' N ' ' A' ' 7' ' ' CYS . 4.3 m -92.71 -76.79 0.46 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.581 -0.699 . . . . 0.0 109.812 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' N ' HG22 ' A' ' 6' ' ' THR . 10.9 m -60.16 -40.47 89.99 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.571 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.846 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -64.61 -48.72 73.86 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 118.886 -1.126 . . . . 0.0 108.919 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.3 m -51.15 -41.85 60.39 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 118.432 -1.307 . . . . 0.0 108.049 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ASN . 3.1 tp-100 -65.52 -21.68 66.64 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 121.446 -0.784 . . . . 0.0 110.661 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.588 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.08 -50.87 5.61 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 179.201 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -42.18 98.54 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.762 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -68.77 -27.52 65.97 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.7 t30 -55.9 -41.11 74.01 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.588 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 2.2 m-85 -88.96 -16.92 30.58 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 tp -72.38 -41.42 66.35 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.354 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 92.4 t -86.17 -27.48 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.858 . . . . 0.0 109.738 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 12.7 m170 -84.06 -49.49 8.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.278 -0.889 . . . . 0.0 109.928 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 p -71.01 -24.54 62.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.302 -0.874 . . . . 0.0 110.645 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 11.3 t -90.5 -47.67 7.57 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.106 -0.996 . . . . 0.0 110.394 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 59.5 t-20 -56.88 -30.9 64.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.065 -1.022 . . . . 0.0 110.045 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.471 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -73.08 -43.03 62.39 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -0.903 . . . . 0.0 109.91 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.563 ' CD1' ' C ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -52.17 -40.0 60.86 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.22 -0.925 . . . . 0.0 108.545 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.56 96.58 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.599 -1.801 . . . . 0.0 108.599 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.571 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -63.53 -13.3 39.92 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.456 -1.026 . . . . 0.0 109.9 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.655 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.0 mm -91.31 -45.22 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' O ' ' N ' ' A' ' 31' ' ' ASN . 6.8 mp -47.29 -26.23 1.18 Allowed 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 176.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.6 m -61.11 -19.45 61.5 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.069 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 m -100.05 -31.78 11.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.424 -0.798 . . . . 0.0 110.736 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.504 ' O ' ' CG ' ' A' ' 31' ' ' ASN . 7.5 p -136.01 -16.55 1.68 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.832 -1.168 . . . . 0.0 111.192 -178.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.913 ' O ' HG23 ' A' ' 32' ' ' VAL . 20.8 p30 41.96 27.79 0.08 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.667 0.746 . . . . 0.0 109.189 -179.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 31' ' ' ASN . 1.4 t -174.31 -54.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.869 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -37.15 -39.75 0.49 Allowed Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -132.81 143.96 49.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.06 -1.259 . . . . 0.0 110.506 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.505 ' HB2' HD11 ' A' ' 27' ' ' LEU . 65.2 m-20 47.63 74.89 0.15 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -0.903 . . . . 0.0 110.326 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 36' ' ' THR . 13.3 t -120.67 63.3 0.86 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.427 ' CD1' ' C ' ' A' ' 37' ' ' TYR . 29.2 p90 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.212 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.226 0.536 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.533 ' H ' ' HB2' ' A' ' 8' ' ' ALA . 36.3 t -52.01 -73.25 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.246 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.45 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER 178.53 -34.8 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.642 ' HB ' HG22 ' A' ' 6' ' ' THR . 75.9 p -125.34 124.28 41.21 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.468 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -42.23 -22.49 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.494 -0.754 . . . . 0.0 109.86 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.642 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.8 t -77.79 -29.3 50.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.0 109.884 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.9 t -89.31 -63.69 1.25 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.189 -0.944 . . . . 0.0 109.634 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.533 ' HB2' ' H ' ' A' ' 2' ' ' CYS . . . -44.58 -51.49 8.94 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.355 -0.841 . . . . 0.0 108.995 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 99.0 m -57.65 -48.06 80.52 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.199 -0.938 . . . . 0.0 109.342 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 6' ' ' THR . 3.0 tp60 -67.77 -17.41 64.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.243 -0.911 . . . . 0.0 110.63 179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.468 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 3.2 ttm180 -91.19 -43.24 9.97 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 3.9 mm? -66.2 -37.08 84.74 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.189 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.26 -29.54 66.35 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.541 -0.724 . . . . 0.0 109.192 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -60.78 -43.83 97.57 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.918 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.608 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.97 -23.56 31.0 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -58.71 -58.33 9.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.396 -0.815 . . . . 0.0 109.862 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.1 -32.53 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.373 -0.83 . . . . 0.0 110.299 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' A' ' 22' ' ' ASN . 5.8 m170 -81.47 -68.16 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.19 -0.944 . . . . 0.0 110.288 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 8.5 t -39.32 -40.17 0.75 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.004 -0.678 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 1.2 t -65.77 -62.12 1.69 Allowed 'General case' 0 C--N 1.297 -1.707 0 O-C-N 120.951 -1.093 . . . . 0.0 109.969 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.783 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -92.47 22.9 4.28 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.329 -0.857 . . . . 0.0 110.543 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 18' ' ' HIS . 11.2 t-20 -92.36 -63.82 1.19 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.041 -1.037 . . . . 0.0 111.049 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.615 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 7.1 p90 -41.74 -33.77 0.54 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.871 0.844 . . . . 0.0 109.29 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.615 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.03 -26.64 23.55 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.624 -1.391 . . . . 0.0 109.624 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.783 ' HB2' ' O ' ' A' ' 21' ' ' ASN . . . -76.68 -21.06 55.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -1.163 . . . . 0.0 110.684 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.878 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.5 mm -90.95 -45.03 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 27' ' ' LEU . 11.6 mt -58.27 -19.8 37.28 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.431 ' O ' ' OG ' ' A' ' 29' ' ' SER . 4.2 m -78.37 -5.56 52.63 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.001 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.431 ' OG ' ' O ' ' A' ' 28' ' ' SER . 50.7 m -165.08 63.66 0.12 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 0.0 109.797 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.585 HG23 ' N ' ' A' ' 31' ' ' ASN . 5.4 t -125.17 -44.88 1.87 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 121.582 0.706 . . . . 0.0 110.217 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.618 ' C ' HG23 ' A' ' 32' ' ' VAL . 1.7 t-20 168.66 -21.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.87 -0.519 . . . . 0.0 110.55 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.618 HG23 ' C ' ' A' ' 31' ' ' ASN . 2.8 t 70.68 13.38 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.191 -0.943 . . . . 0.0 110.155 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 31' ' ' ASN . . . -135.15 -107.8 0.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.1 m -114.92 -26.92 7.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.275 -1.132 . . . . 0.0 110.065 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.437 ' O ' ' C ' ' A' ' 36' ' ' THR . 11.3 t30 55.36 -163.89 0.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.351 -0.843 . . . . 0.0 110.697 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 35' ' ' ASN . 17.7 p -37.79 98.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.708 -0.62 . . . . 0.0 110.947 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 35' ' ' ASN . 10.2 p90 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.087 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.209 0.528 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 22.8 m -112.89 -116.56 0.32 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.22 -0.925 . . . . 0.0 109.798 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' A' ' 4' ' ' THR . 11.6 t-20 -162.44 17.64 0.09 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.145 -0.972 . . . . 0.0 110.147 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.8 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.7 OUTLIER 72.88 -83.51 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 O-C-N 120.946 -1.096 . . . . 0.0 109.911 -179.714 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -44.93 -22.05 0.08 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.534 -1.354 . . . . 0.0 108.748 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.523 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -91.4 -75.29 0.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.328 -0.858 . . . . 0.0 110.941 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HB2' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -63.19 -25.9 68.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.912 -1.117 . . . . 0.0 109.49 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.8 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -70.65 -56.99 5.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.741 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 44.5 p -56.58 -28.27 59.87 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.386 -1.326 . . . . 0.0 107.902 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 33.5 mm-40 -78.28 -22.15 48.68 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.553 0.692 . . . . 0.0 109.616 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.07 -42.04 13.37 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.621 HD23 ' O ' ' A' ' 8' ' ' ALA . 3.7 mm? -57.3 -45.05 84.52 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.55 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.9 -22.28 65.09 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -63.88 -45.31 89.97 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.589 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 9.0 m-85 -65.94 -23.41 66.6 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -55.35 -40.27 71.06 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.9 t -85.65 -44.97 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 120.109 -0.637 . . . . 0.0 109.955 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.489 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 21.9 m-70 -66.84 -50.03 63.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.217 -0.927 . . . . 0.0 109.693 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.2 t -55.51 -53.34 57.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 0.0 109.711 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 t -61.02 -18.83 59.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.374 -0.828 . . . . 0.0 109.9 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 53.1 t30 -74.19 -49.91 21.46 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.219 -0.925 . . . . 0.0 110.036 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 5.1 t-20 -65.22 -53.09 49.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.438 -0.789 . . . . 0.0 109.784 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.494 ' CZ ' ' CD2' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -52.4 -35.46 51.78 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.395 -0.815 . . . . 0.0 109.002 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.2 -17.94 75.44 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.697 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -74.32 -19.51 60.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.38 -1.071 . . . . 0.0 109.902 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.825 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -91.36 -51.71 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' CD2' ' CZ ' ' A' ' 23' ' ' PHE . 3.8 mp -51.61 -23.82 4.74 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.3 m -59.41 -13.11 7.3 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.539 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.77 ' O ' HG22 ' A' ' 30' ' ' THR . 0.3 OUTLIER -91.69 -59.66 2.07 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.127 -0.983 . . . . 0.0 109.444 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.77 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 64.58 -48.51 0.32 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.457 -0.777 . . . . 0.0 111.216 179.423 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.528 ' N ' ' O ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -83.09 12.15 5.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.146 -0.971 . . . . 0.0 110.035 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.7 p -70.84 -3.1 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.212 -0.93 . . . . 0.0 110.316 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.88 51.54 0.11 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -158.11 -83.21 0.05 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.34 -1.094 . . . . 0.0 110.47 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' THR . 71.3 m-80 -84.45 161.65 20.23 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.4 -0.812 . . . . 0.0 110.414 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 35' ' ' ASN . 27.1 p 44.56 96.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.231 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.151 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.232 0.539 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 1.0 OUTLIER -69.91 -85.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.274 -0.891 . . . . 0.0 110.591 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 13.8 t-20 170.08 -26.75 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.611 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.0 OUTLIER -132.78 124.91 28.97 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -40.41 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.651 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.611 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.7 t -67.36 -39.13 85.68 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 108.782 178.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.6 t -79.25 -47.61 15.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.25 77.37 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 18.7 m -56.14 -39.61 72.53 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.6 tp60 -69.1 -19.25 64.05 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.65 0.738 . . . . 0.0 109.418 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 1.7 mmm180 -87.61 -51.28 5.98 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 105.264 -2.124 . . . . 0.0 105.264 177.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.918 ' O ' HD13 ' A' ' 16' ' ' LEU . 10.6 mt -56.08 -29.94 61.29 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.648 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.78 -26.1 62.29 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 30.6 t-20 -58.94 -46.76 87.19 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CB ' ' A' ' 19' ' ' SER . 2.1 m-85 -76.94 -21.18 55.19 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.918 HD13 ' O ' ' A' ' 12' ' ' LEU . 4.9 mp -67.33 -67.58 0.44 Allowed 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.176 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 71.8 t -58.63 -26.31 30.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 110.445 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 48.2 m80 -88.56 -52.8 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.187 -0.946 . . . . 0.0 111.298 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.0 p -68.81 -32.62 72.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.281 -0.887 . . . . 0.0 110.145 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 59.7 m -74.47 -40.26 61.99 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.997 -1.065 . . . . 0.0 109.1 179.091 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -45.04 -36.51 3.55 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.111 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.492 ' O ' HG12 ' A' ' 26' ' ' ILE . 8.8 t30 -62.52 -62.05 2.01 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.995 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.04 -26.39 10.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.468 -0.77 . . . . 0.0 109.515 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.03 -37.99 36.55 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.689 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -67.11 -9.92 44.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.266 -1.138 . . . . 0.0 109.918 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.799 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.2 mm -91.25 -44.96 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.908 ' O ' HG22 ' A' ' 30' ' ' THR . 11.8 mt -49.24 -27.23 3.54 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.5 m -58.39 -34.6 70.91 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.825 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.89 11.82 13.6 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.576 -0.703 . . . . 0.0 110.102 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.908 HG22 ' O ' ' A' ' 27' ' ' LEU . 2.5 t -45.32 -54.98 6.43 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.084 0.945 . . . . 0.0 109.632 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.917 ' O ' HG22 ' A' ' 32' ' ' VAL . 14.1 p30 -148.97 13.68 0.89 Allowed 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.917 HG22 ' O ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER 56.97 39.1 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 121.771 0.796 . . . . 0.0 110.371 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' N ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.01 -80.57 0.11 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.901 -0.879 . . . . 0.0 110.901 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 t -82.51 171.23 14.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.193 -1.181 . . . . 0.0 111.774 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 37' ' ' TYR . 10.7 t30 61.9 157.61 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.609 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.591 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 4.0 t -61.1 79.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.433 -0.792 . . . . 0.0 109.201 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.598 ' OXT' ' CD2' ' A' ' 37' ' ' TYR . 3.1 p90 . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.982 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.174 0.511 . . . . 0.0 110.076 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 52.6 t -179.49 -76.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 110.243 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 42.2 t30 177.03 -33.57 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.917 0.865 . . . . 0.0 108.799 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.548 ' CB ' HG22 ' A' ' 6' ' ' THR . 14.7 p -132.37 122.94 25.83 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.499 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -39.88 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.679 -0.638 . . . . 0.0 109.555 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.548 HG22 ' CB ' ' A' ' 4' ' ' THR . 6.1 t -64.37 -42.45 96.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' CG2' ' A' ' 6' ' ' THR . 5.3 t -84.12 -42.99 15.46 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.461 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -60.82 -53.38 58.06 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.499 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 85.3 m -55.55 -38.59 69.5 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.875 -1.13 . . . . 0.0 108.147 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -71.13 -21.26 62.22 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.846 0.832 . . . . 0.0 109.394 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -87.01 -43.03 12.65 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' O ' HD23 ' A' ' 16' ' ' LEU . 2.3 mm? -57.57 -39.57 77.03 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.791 176.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.82 -28.34 67.48 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.63 -43.32 97.65 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.507 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -75.81 -17.85 59.7 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.045 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.7 OUTLIER -67.11 -38.66 86.01 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.591 -0.844 . . . . 0.0 108.978 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 46.7 t -86.41 -29.2 5.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.592 -0.692 . . . . 0.0 109.335 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 28.5 m170 -85.1 -51.56 6.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.369 -0.832 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.3 p -68.81 -39.92 79.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.812 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.587 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 7.8 t -69.1 -52.62 26.43 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.192 -0.943 . . . . 0.0 110.037 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.495 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 24.7 t-20 -45.08 -31.25 1.31 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.638 -0.664 . . . . 0.0 110.917 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.428 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -43.78 -45.39 7.24 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.033 -1.042 . . . . 0.0 110.244 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.587 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -57.77 -14.44 5.82 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.449 -0.782 . . . . 0.0 110.159 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.57 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.51 -28.33 17.1 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.701 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -65.74 -25.22 67.19 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.41 -1.053 . . . . 0.0 109.752 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.836 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.7 mm -90.76 -46.69 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 23' ' ' PHE . 4.2 mm? -61.44 -17.45 54.44 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.4 m -69.46 -0.38 6.44 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.15 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.79 5.04 32.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.686 -1.259 . . . . 0.0 110.705 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.653 HG23 ' N ' ' A' ' 31' ' ' ASN . 4.6 t -58.11 -47.88 81.89 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-O 122.227 1.013 . . . . 0.0 109.045 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.653 ' N ' HG23 ' A' ' 30' ' ' THR . 46.6 t-20 176.3 27.33 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 115.441 -0.799 . . . . 0.0 108.955 179.206 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.516 ' O ' ' N ' ' A' ' 34' ' ' SER . 32.6 m -123.13 43.83 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.378 -0.826 . . . . 0.0 109.042 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -38.24 -28.35 0.05 OUTLIER Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.516 ' N ' ' O ' ' A' ' 32' ' ' VAL . 1.9 t 67.47 22.08 9.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.234 -1.157 . . . . 0.0 109.658 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.445 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.7 t30 -88.1 166.03 14.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.518 -0.739 . . . . 0.0 109.945 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' ASN . 6.2 m 54.69 105.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.357 -0.839 . . . . 0.0 110.042 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 p90 . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.22 -179.831 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.462 ' HB3' ' HB1' ' A' ' 8' ' ' ALA . 11.8 mttt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.296 0.57 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 41.9 t -45.66 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.388 -0.82 . . . . 0.0 110.05 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.0 t-20 178.52 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.539 ' CG2' HG22 ' A' ' 6' ' ' THR . 3.0 m -121.51 121.53 37.71 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.514 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.53 -24.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.264 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.576 HG23 ' N ' ' A' ' 7' ' ' CYS . 14.9 t -74.61 -40.77 61.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.211 -0.931 . . . . 0.0 109.372 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.576 ' N ' HG23 ' A' ' 6' ' ' THR . 9.4 t -77.31 -57.79 3.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.423 -0.798 . . . . 0.0 109.829 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.83 -46.27 51.0 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.385 -0.822 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 22.1 m -64.77 -44.16 90.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.818 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.5 tp60 -78.15 -10.95 59.87 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.362 -0.836 . . . . 0.0 111.122 -179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.6 OUTLIER -91.38 -51.72 5.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 7.5 mt -58.51 -45.22 89.24 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.869 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.455 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . . . -64.52 -27.4 68.94 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 11' ' ' ARG . 20.1 t-20 -53.36 -46.92 69.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -90.68 -20.14 22.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.535 -0.728 . . . . 0.0 109.07 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -70.68 -40.4 72.95 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.507 -0.877 . . . . 0.0 109.629 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 33.1 t -84.64 -29.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.303 -0.873 . . . . 0.0 109.619 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 9.9 m170 -85.86 -47.52 9.61 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.465 -0.772 . . . . 0.0 110.924 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.558 ' HA ' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -78.22 -22.95 47.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.244 -0.91 . . . . 0.0 111.692 -178.555 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 4.2 p -91.12 -40.43 11.6 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.592 -1.318 . . . . 0.0 111.423 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 1.071 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 8.2 t30 -90.69 -42.47 10.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.044 -1.035 . . . . 0.0 111.669 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.578 ' HA ' HG12 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -85.39 -45.41 11.91 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 120.813 -1.179 . . . . 0.0 111.513 -178.658 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 19' ' ' SER . 4.2 t80 -77.52 -40.12 43.78 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.108 -0.995 . . . . 0.0 111.339 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.86 -40.88 5.48 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.614 -1.279 . . . . 0.0 111.625 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 1.071 ' HB3' ' O ' ' A' ' 21' ' ' ASN . . . -75.55 -24.5 56.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.613 -1.521 . . . . 0.0 111.668 -178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.667 ' N ' HD13 ' A' ' 26' ' ' ILE . 3.7 mm -92.28 -42.53 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.63 -1.294 . . . . 0.0 108.594 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 23' ' ' PHE 0.262 3.0 mm? -50.42 -27.39 6.33 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.461 ' O ' ' OG ' ' A' ' 29' ' ' SER . 50.2 m -78.05 -22.54 48.97 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.623 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 26' ' ' ILE . 74.6 m -167.62 66.72 0.08 Allowed 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.343 -0.848 . . . . 0.0 109.672 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.434 HG21 ' HB2' ' A' ' 34' ' ' SER . 4.8 t -59.44 -30.0 68.18 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.012 -1.106 . . . . 0.0 108.012 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.935 ' O ' HG13 ' A' ' 32' ' ' VAL . 1.4 p-10 -164.54 -30.19 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.757 178.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.935 HG13 ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER 178.57 39.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.342 -0.849 . . . . 0.0 109.855 178.583 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . 102.21 -44.99 1.42 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 33' ' ' GLY . 5.6 t 56.34 45.13 23.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.112 -1.228 . . . . 0.0 110.203 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.458 ' O ' ' OG1' ' A' ' 36' ' ' THR . 25.3 t30 -84.89 138.26 32.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.318 -0.863 . . . . 0.0 110.061 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 35' ' ' ASN . 46.5 p 44.53 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.168 -0.957 . . . . 0.0 110.067 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.29 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.5 tttm . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.211 0.529 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 83.1 m -115.06 -116.2 0.33 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 0.0 109.494 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.54 ' O ' ' CB ' ' A' ' 4' ' ' THR . 8.5 t30 -148.8 10.85 0.83 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.279 -0.888 . . . . 0.0 109.607 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.908 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.5 m 77.57 -82.06 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.159 0 O-C-N 121.471 -0.768 . . . . 0.0 110.468 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.542 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . -43.86 -21.92 0.05 OUTLIER 'General case' 0 C--N 1.295 -1.796 0 O-C-N 120.818 -1.176 . . . . 0.0 109.542 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.7 p -91.47 -85.84 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.134 -0.979 . . . . 0.0 110.595 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 6' ' ' THR . 2.1 m -55.82 -30.45 61.42 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.538 -0.726 . . . . 0.0 109.625 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.908 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -74.63 -58.9 2.99 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.114 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.816 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 1.5 t -50.67 -27.15 6.42 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 118.347 -1.341 . . . . 0.0 109.623 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -70.75 -35.71 72.78 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 14.4 ttp180 -88.21 -39.73 14.25 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.1 mm? -64.24 -25.99 68.31 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.077 176.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.816 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -67.56 -43.18 81.28 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 121.725 0.774 . . . . 0.0 109.719 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.554 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 40.7 t30 -56.32 -42.66 78.01 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.561 0.696 . . . . 0.0 109.639 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -86.65 -12.98 46.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.636 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -69.5 -40.4 77.02 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.284 -0.966 . . . . 0.0 108.967 179.226 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.469 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 46.3 t -80.73 -33.06 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.297 -0.877 . . . . 0.0 109.256 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -81.97 -48.78 11.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.462 -0.774 . . . . 0.0 110.495 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.6 t -70.75 -50.4 36.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.212 -0.93 . . . . 0.0 110.794 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 3.4 t -61.39 -38.67 87.9 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.329 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.469 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 26.2 t30 -64.06 -10.4 21.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.298 -0.876 . . . . 0.0 109.95 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.447 ' O ' HG12 ' A' ' 26' ' ' ILE . 29.7 t30 -47.6 -77.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.259 -0.901 . . . . 0.0 110.209 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.64 ' O ' HD23 ' A' ' 27' ' ' LEU . 18.4 p90 -56.24 -24.4 42.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.394 -0.816 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.94 -38.06 64.77 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.715 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -71.37 -21.45 62.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -1.151 . . . . 0.0 110.422 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.877 ' O ' HG23 ' A' ' 30' ' ' THR . 2.4 mm -91.92 -42.71 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD23 ' O ' ' A' ' 23' ' ' PHE . 0.6 OUTLIER -48.14 -27.06 2.15 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 176.553 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.4 m -62.03 -12.66 19.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.05 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -152.99 54.41 0.77 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.234 -0.916 . . . . 0.0 110.632 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.877 HG23 ' O ' ' A' ' 26' ' ' ILE . 72.7 p -133.23 -43.81 0.85 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.255 -0.903 . . . . 0.0 110.651 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -46.43 -25.94 0.75 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.338 -0.851 . . . . 0.0 109.465 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -33.9 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 CA-C-O 121.449 0.643 . . . . 0.0 109.504 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 30' ' ' THR . . . 133.36 102.08 0.78 Allowed Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.3 t -116.19 31.77 6.52 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.259 -1.142 . . . . 0.0 109.988 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -103.4 55.58 0.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.288 -0.883 . . . . 0.0 110.264 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.548 ' C ' ' CD2' ' A' ' 37' ' ' TYR . 41.0 p -108.84 71.77 0.79 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.285 -0.884 . . . . 0.0 110.487 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.548 ' CD2' ' C ' ' A' ' 36' ' ' THR . 39.2 p90 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.539 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.8 mtmm . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.17 0.51 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 26.9 t -98.53 -108.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.179 -0.95 . . . . 0.0 110.099 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.536 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 7.9 t-20 169.6 -21.29 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.044 -1.035 . . . . 0.0 109.695 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -113.21 108.57 17.46 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.249 -0.907 . . . . 0.0 109.813 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -38.73 -28.98 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.51 0.672 . . . . 0.0 109.689 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 4' ' ' THR . 9.4 t -67.01 -44.91 79.1 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.629 ' N ' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -72.25 -39.08 68.71 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.097 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -62.45 -53.51 53.73 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 18.2 m -57.39 -33.81 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.468 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.8 -27.73 66.13 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.47 -0.769 . . . . 0.0 109.803 179.273 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -87.56 -47.12 8.96 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -58.99 -22.57 60.76 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.146 176.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 16' ' ' LEU . . . -73.53 -37.71 65.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.885 0.85 . . . . 0.0 109.287 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -57.82 -42.5 84.43 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.582 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -81.64 -17.22 48.88 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.804 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 13' ' ' ALA . 5.6 mt -66.04 -61.04 2.26 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.85 -1.14 . . . . 0.0 108.508 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -56.34 -41.98 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.773 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -72.84 -56.67 4.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.39 -0.819 . . . . 0.0 110.528 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.571 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.4 t -65.6 -50.52 64.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.291 -0.88 . . . . 0.0 110.618 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 70.7 m -44.31 -44.61 8.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.097 -1.002 . . . . 0.0 109.428 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -51.01 -41.74 59.97 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.454 -0.899 . . . . 0.0 109.001 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 1.3 t30 -73.27 -54.66 7.84 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.613 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -51.78 -30.35 22.59 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.407 ' HA2' ' HB2' ' A' ' 27' ' ' LEU . . . -77.01 -28.17 59.07 Favored Glycine 0 N--CA 1.486 2.029 0 N-CA-C 108.309 -1.916 . . . . 0.0 108.309 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.712 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -65.0 -18.41 65.27 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.442 -1.034 . . . . 0.0 108.998 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.824 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.0 mm -91.57 -39.57 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.683 ' O ' HG22 ' A' ' 30' ' ' THR . 3.6 mp -63.38 -13.49 40.04 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 176.319 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.8 m -75.44 -1.93 26.36 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 121.793 -0.567 . . . . 0.0 109.916 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 m -143.61 8.49 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.211 -0.93 . . . . 0.0 110.878 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.689 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -55.74 -78.41 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.21 -0.931 . . . . 0.0 109.653 179.652 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.689 ' H ' HG23 ' A' ' 30' ' ' THR . 0.1 OUTLIER -136.7 8.95 3.08 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.446 -0.784 . . . . 0.0 109.102 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' A' ' 31' ' ' ASN . 10.8 t 65.82 5.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 O-C-N 121.522 -0.736 . . . . 0.0 110.745 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 165.61 -92.98 0.11 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -170.9 40.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -1.096 . . . . 0.0 110.093 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.445 ' O ' ' O ' ' A' ' 34' ' ' SER . 54.4 t30 57.3 111.06 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.358 -0.839 . . . . 0.0 110.248 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 35.1 m -62.66 93.29 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.192 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.0 p90 . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.142 -179.837 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.432 ' HB3' ' NZ ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.167 0.508 . . . . 0.0 110.239 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 3.3 m -93.61 -65.24 1.01 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.24 -0.913 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 9.6 t30 175.5 -32.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.53 ' O ' ' N ' ' A' ' 7' ' ' CYS . 3.1 m -99.23 115.13 28.41 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.57 -27.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.337 0.589 . . . . 0.0 109.816 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.555 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 5.2 t -67.72 -45.08 76.09 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.219 -0.925 . . . . 0.0 108.619 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' CG2' ' A' ' 6' ' ' THR . 38.9 t -76.53 -49.97 15.11 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.318 -0.864 . . . . 0.0 108.733 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.479 ' O ' HD13 ' A' ' 12' ' ' LEU . . . -51.62 -51.07 58.6 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.478 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.7 m -59.71 -45.97 90.51 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.426 -0.796 . . . . 0.0 108.952 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.535 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -69.63 -13.17 62.17 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.155 -0.966 . . . . 0.0 109.96 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -91.1 -52.85 4.63 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 8' ' ' ALA . 4.1 mp -52.0 -42.43 63.0 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.61 -31.17 72.25 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.19 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 3.7 t-20 -53.26 -52.67 58.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.45 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 2.6 m-85 -60.92 -22.03 63.97 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.25 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.553 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.6 tp -75.77 -38.66 58.15 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.696 0.76 . . . . 0.0 109.149 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.59 ' HA ' ' HB3' ' A' ' 21' ' ' ASN . 17.7 t -88.32 -36.35 9.11 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.235 -0.915 . . . . 0.0 109.366 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.4 m-70 -74.65 -52.85 10.57 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.13 -0.981 . . . . 0.0 111.153 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.93 -31.37 15.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.245 -0.909 . . . . 0.0 112.273 -178.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER -91.05 -27.21 18.76 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.746 -1.221 . . . . 0.0 112.648 -178.043 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.59 ' HB3' ' HA ' ' A' ' 17' ' ' VAL . 0.2 OUTLIER -77.75 -12.72 60.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.337 -1.477 . . . . 0.0 110.492 -179.462 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 26' ' ' ILE . 7.7 t-20 -42.31 -66.41 0.36 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.923 -1.11 . . . . 0.0 110.365 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.566 ' CE2' ' O ' ' A' ' 20' ' ' SER . 6.7 p90 -60.32 -31.35 70.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.265 -0.897 . . . . 0.0 110.363 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.555 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -77.93 -20.59 73.03 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.707 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -78.75 -19.97 51.04 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.295 -1.121 . . . . 0.0 109.937 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.807 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.0 mm -90.49 -47.1 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.4 mm? -51.42 -25.46 6.3 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 8.8 m -76.52 5.22 7.68 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.458 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.487 ' N ' ' O ' ' A' ' 26' ' ' ILE . 1.3 m -178.29 52.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.059 -1.025 . . . . 0.0 110.438 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 0.3 OUTLIER -93.83 -73.31 0.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.175 -0.953 . . . . 0.0 108.615 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.708 ' O ' HG12 ' A' ' 32' ' ' VAL . 30.2 p30 -122.92 -4.61 8.56 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.742 HG13 ' HB3' ' A' ' 35' ' ' ASN . 0.3 OUTLIER 55.15 36.57 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.716 -0.615 . . . . 0.0 109.872 -179.791 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.544 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -21.26 -50.72 0.01 OUTLIER Glycine 0 N--CA 1.502 3.055 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.503 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -67.05 79.09 0.13 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -1.195 . . . . 0.0 109.67 179.359 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.742 ' HB3' HG13 ' A' ' 32' ' ' VAL . 9.0 p30 -153.52 176.06 12.48 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.0 110.454 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.411 ' O ' ' C ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -49.7 103.73 0.05 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.313 -0.867 . . . . 0.0 109.946 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 1.1 p90 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.31 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.463 ' O ' ' HE3' ' A' ' 1' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.461 0.648 . . . . 0.0 110.355 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -132.09 -74.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.853 . . . . 0.0 109.375 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.635 ' O ' HG23 ' A' ' 4' ' ' THR . 7.2 t-20 162.25 -25.47 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.643 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.1 OUTLIER -166.95 139.88 3.6 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -41.61 -23.32 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.5 t -72.32 -39.88 67.87 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 4' ' ' THR . 43.6 t -70.03 -40.26 75.29 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.75 -48.41 63.8 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.621 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 5.5 m -57.71 -32.63 67.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 35.0 tt0 -69.26 -25.19 64.14 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.74 0.781 . . . . 0.0 109.687 179.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -88.64 -53.55 4.58 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.288 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -50.3 -37.83 38.37 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 175.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.621 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -63.72 -31.45 72.62 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -50.98 -44.55 60.81 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.2 m-85 -91.59 -26.79 18.55 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -70.75 -43.87 67.93 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 118.619 -1.232 . . . . 0.0 108.693 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 23.9 t -73.51 -31.64 33.56 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.256 178.702 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 0.4 OUTLIER -85.18 -36.56 20.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.416 -0.803 . . . . 0.0 110.693 -179.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.5 t -89.4 -20.36 24.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.182 -0.949 . . . . 0.0 111.416 -178.749 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 20.2 m -89.75 -46.43 8.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.758 -1.214 . . . . 0.0 110.641 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 2.9 m-80 -56.06 -16.32 4.85 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 109.762 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' O ' HG12 ' A' ' 26' ' ' ILE . 2.5 m-20 -37.07 -46.62 0.68 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.582 -0.699 . . . . 0.0 110.795 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 26' ' ' ILE . 15.8 m-85 -63.79 -45.92 87.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.14 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.442 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -47.63 -26.88 4.13 Favored Glycine 0 N--CA 1.485 1.963 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -84.13 -24.08 30.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.716 -0.873 . . . . 0.0 110.153 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.537 ' N ' HD13 ' A' ' 26' ' ' ILE . 5.6 mm -91.83 -53.83 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 27' ' ' LEU . 4.0 mm? -49.78 -30.24 9.23 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 176.298 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -47.53 -35.77 9.43 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.131 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.616 ' C ' HG22 ' A' ' 30' ' ' THR . 39.3 m -112.58 -67.99 0.96 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.748 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.8 OUTLIER 159.9 -57.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.89 0.852 . . . . 0.0 109.859 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.748 ' H ' HG23 ' A' ' 30' ' ' THR . 10.3 p30 -153.61 -1.48 0.21 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.902 -0.499 . . . . 0.0 111.243 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 33' ' ' GLY . 7.8 p -175.21 -45.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.707 -1.245 . . . . 0.0 110.586 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.599 ' N ' HG13 ' A' ' 32' ' ' VAL . . . 106.3 -56.94 0.49 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.416 -1.473 . . . . 0.0 109.416 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.2 p -144.96 -95.88 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.266 -1.138 . . . . 0.0 110.39 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -124.23 179.14 5.01 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.079 -1.013 . . . . 0.0 110.099 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.729 HG23 ' O ' ' A' ' 36' ' ' THR . 13.1 t -44.85 105.81 0.06 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.099 -1.001 . . . . 0.0 110.087 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' C ' ' A' ' 37' ' ' TYR . 18.3 p90 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.305 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.148 0.499 . . . . 0.0 109.971 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 7.6 t -44.79 -68.43 0.2 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.263 -0.898 . . . . 0.0 110.431 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 7.0 t30 171.1 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.481 -0.762 . . . . 0.0 108.968 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.75 ' CG2' HG22 ' A' ' 6' ' ' THR . 2.5 m -136.97 120.38 16.98 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.661 -0.649 . . . . 0.0 109.348 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.69 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.75 HG22 ' CG2' ' A' ' 4' ' ' THR . 8.9 t -73.76 -40.27 63.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.519 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.606 ' N ' HG23 ' A' ' 6' ' ' THR . 7.0 t -72.31 -54.42 9.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.608 -0.682 . . . . 0.0 109.91 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.22 -36.6 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 109.357 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 40.9 m -73.43 -42.98 61.35 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.404 -0.81 . . . . 0.0 109.381 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' ' 7' ' ' CYS . 8.2 pt20 -83.28 -5.26 59.07 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 121.362 -0.836 . . . . 0.0 110.472 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.527 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -90.43 -51.71 5.28 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -63.47 -49.33 74.06 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.035 176.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.498 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.15 -21.79 65.34 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.527 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 4.1 t-20 -55.98 -59.59 4.69 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.6 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -57.26 -22.95 45.04 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.658 -1.217 . . . . 0.0 108.036 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -74.72 -41.24 60.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.64 -0.824 . . . . 0.0 109.28 179.117 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.554 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 6.9 t -90.33 -42.81 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.212 -0.93 . . . . 0.0 110.033 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.596 ' HA ' ' HB2' ' A' ' 22' ' ' ASN . 16.3 m80 -67.67 -36.94 81.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.427 -0.796 . . . . 0.0 110.843 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -90.17 -42.64 10.94 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.348 -178.286 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -91.71 -42.5 10.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.02 -1.05 . . . . 0.0 112.9 -177.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.554 ' HB2' ' HA ' ' A' ' 17' ' ' VAL . 0.9 OUTLIER -92.37 -36.18 13.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.973 -1.079 . . . . 0.0 112.561 -177.747 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.596 ' HB2' ' HA ' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -61.27 -46.64 89.52 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.987 -1.071 . . . . 0.0 111.39 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.486 ' CD2' ' O ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -53.21 -30.29 36.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.042 -1.036 . . . . 0.0 109.482 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.445 ' O ' ' CB ' ' A' ' 28' ' ' SER . . . -82.31 -32.09 29.31 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 108.948 -1.661 . . . . 0.0 108.948 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.764 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -62.62 -16.07 54.89 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.459 -1.024 . . . . 0.0 109.821 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.898 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.3 mm -91.68 -44.19 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.452 ' O ' ' CG2' ' A' ' 30' ' ' THR 0.25 0.9 OUTLIER -71.85 -7.75 50.22 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 175.901 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.528 ' HB2' ' HA ' ' A' ' 25' ' ' ALA . 3.5 m -90.74 -16.46 28.39 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.465 0.65 . . . . 0.0 110.262 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 30' ' ' THR . 0.1 OUTLIER -66.84 -32.83 74.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.941 . . . . 0.0 111.398 -178.433 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.695 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -43.26 -71.08 0.09 Allowed 'General case' 0 C--N 1.292 -1.907 0 CA-C-O 121.916 0.865 . . . . 0.0 109.069 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.695 ' H ' HG23 ' A' ' 30' ' ' THR . 26.1 t30 -139.09 8.04 2.47 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.59 HG12 ' O ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER 73.99 0.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.401 -0.812 . . . . 0.0 110.259 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.14 -56.79 4.59 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -159.28 171.57 19.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.181 -1.188 . . . . 0.0 110.31 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 46.09 76.65 0.09 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.127 -0.983 . . . . 0.0 109.923 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.456 ' O ' ' OXT' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -124.76 67.32 1.1 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.303 -0.873 . . . . 0.0 110.394 -179.782 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.456 ' OXT' ' O ' ' A' ' 36' ' ' THR . 51.9 p90 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 117.894 -1.05 . . . . 0.0 110.091 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.9 mptt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.378 0.608 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 40.0 t -177.07 -95.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.581 ' O ' HG23 ' A' ' 4' ' ' THR . 17.7 t-20 173.46 24.21 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.64 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.0 OUTLIER 167.02 113.43 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -42.6 -16.59 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.316 -0.865 . . . . 0.0 111.365 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.64 HG22 ' HB ' ' A' ' 4' ' ' THR . 3.3 t -87.33 -30.41 20.85 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.027 -1.046 . . . . 0.0 108.285 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 11.8 p -85.12 -38.13 19.43 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -64.69 -46.92 80.34 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.3 p -58.79 -42.11 88.29 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 6' ' ' THR . 15.3 mm100 -75.57 -13.93 60.37 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 121.507 0.67 . . . . 0.0 109.804 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 12.4 tpp180 -90.12 -43.09 10.7 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -62.27 -44.54 96.3 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.557 -1.201 . . . . 0.0 108.767 177.183 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.57 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.7 -25.6 67.39 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t30 -58.79 -44.35 90.7 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.89 -19.59 34.51 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.3 tp -71.87 -63.9 1.04 Allowed 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.218 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.557 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 64.3 t -61.44 -25.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.045 . . . . 0.0 109.697 179.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.521 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 18.3 m80 -86.66 -53.03 5.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.251 -0.906 . . . . 0.0 110.648 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -79.56 -25.12 41.69 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.268 -0.895 . . . . 0.0 111.278 -178.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.6 t -90.48 -42.94 10.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.02 -1.05 . . . . 0.0 110.847 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.692 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 6.9 t-20 -66.35 -54.5 23.79 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.065 -1.022 . . . . 0.0 110.257 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.602 ' HA ' HG12 ' A' ' 26' ' ' ILE . 5.1 m120 -56.4 -31.13 63.57 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 110.195 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.744 ' O ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -75.11 -51.79 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.164 -0.96 . . . . 0.0 110.908 -179.349 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.98 -33.94 8.61 Favored Glycine 0 N--CA 1.493 2.484 0 C-N-CA 119.981 -1.104 . . . . 0.0 110.929 -178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.692 ' HB3' ' O ' ' A' ' 21' ' ' ASN . . . -70.44 -28.97 65.44 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.012 -1.287 . . . . 0.0 111.416 -178.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.602 HG12 ' HA ' ' A' ' 22' ' ' ASN . 5.8 mm -92.1 -41.47 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.659 -1.275 . . . . 0.0 108.351 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.744 HD12 ' O ' ' A' ' 23' ' ' PHE . 11.2 mt -51.45 -25.23 6.03 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.132 -1.432 . . . . 0.0 107.132 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.3 m -68.03 -8.95 42.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.998 179.048 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.46 ' HB3' ' HA ' ' A' ' 32' ' ' VAL . 24.6 m -158.47 59.28 0.45 Allowed 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.456 -0.777 . . . . 0.0 109.606 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 4.8 t -56.0 -42.01 75.76 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.007 0.908 . . . . 0.0 108.961 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.595 ' N ' ' CG2' ' A' ' 30' ' ' THR . 5.1 p-10 -95.33 9.89 38.21 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.826 ' O ' HG12 ' A' ' 32' ' ' VAL . 9.8 t 60.47 50.32 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-O 122.32 1.057 . . . . 0.0 109.382 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . -118.19 -100.47 2.02 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLY . 0.3 OUTLIER 41.34 27.16 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -1.143 . . . . 0.0 110.35 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 33' ' ' GLY . 18.4 t-20 -134.94 53.68 1.98 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.411 -0.806 . . . . 0.0 109.874 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.48 94.85 3.38 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.787 . . . . 0.0 110.084 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 p90 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 118.047 -0.978 . . . . 0.0 109.98 179.974 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 2' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.281 0.562 . . . . 0.0 110.209 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' C ' ' O ' ' A' ' 1' ' ' LYS . 44.4 t -40.42 -70.6 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.493 -0.754 . . . . 0.0 110.469 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 6.9 t30 178.8 -37.07 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.714 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.7 OUTLIER -126.89 127.17 44.5 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.525 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.93 -21.29 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.714 HG22 ' OG1' ' A' ' 4' ' ' THR . 7.2 t -75.6 -37.74 59.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.093 -1.005 . . . . 0.0 109.644 179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.535 ' H ' HG23 ' A' ' 4' ' ' THR . 36.0 t -83.15 -62.52 1.57 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.747 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -43.22 -63.33 0.83 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.124 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.535 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 91.9 m -48.5 -42.05 31.74 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.793 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.541 ' HB2' ' O ' ' A' ' 6' ' ' THR . 41.7 tt0 -61.07 -31.6 71.26 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 121.044 -1.035 . . . . 0.0 110.949 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' CG ' ' CZ ' ' A' ' 15' ' ' PHE . 17.3 ttp85 -92.2 -44.98 8.48 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.833 -1.167 . . . . 0.0 107.853 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 5.5 mp -61.83 -45.77 92.39 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.538 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.74 -28.67 68.6 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t-20 -54.04 -42.61 69.4 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.32 -18.31 28.76 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.657 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 6.7 tp -71.76 -36.57 70.44 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.444 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.543 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 34.2 t -87.83 -35.52 8.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.166 -0.959 . . . . 0.0 109.347 178.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 6.9 m-70 -79.29 -48.54 13.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.412 -0.805 . . . . 0.0 111.211 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -90.13 -29.68 18.14 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.917 -1.114 . . . . 0.0 112.287 -178.3 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -91.05 -27.16 18.79 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.695 -1.253 . . . . 0.0 111.971 -178.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 5.9 t-20 -76.42 -34.01 58.8 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.656 -1.277 . . . . 0.0 110.804 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.5 ' O ' HG12 ' A' ' 26' ' ' ILE . 55.1 t30 -81.13 -44.66 17.58 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.966 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.557 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -57.74 -36.3 71.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.326 -0.859 . . . . 0.0 110.156 -179.614 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.468 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -78.28 -27.86 56.95 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.738 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -68.23 -22.26 64.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.281 -1.129 . . . . 0.0 111.259 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.795 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.1 mm -91.79 -43.65 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 120.832 -1.167 . . . . 0.0 108.655 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD13 ' O ' ' A' ' 23' ' ' PHE . 6.2 mp -49.08 -26.4 2.66 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.0 m -62.28 -20.79 64.64 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.607 0.718 . . . . 0.0 109.645 178.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.697 ' O ' HG22 ' A' ' 30' ' ' THR . 22.3 m -148.03 -72.61 0.2 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.717 -0.615 . . . . 0.0 109.792 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 29' ' ' SER . 0.6 OUTLIER 91.51 -39.26 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.295 0 CA-C-O 121.49 0.662 . . . . 0.0 109.696 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' O ' HG12 ' A' ' 32' ' ' VAL . 52.2 p-10 -156.21 12.14 0.29 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.569 -0.707 . . . . 0.0 110.387 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 32' ' ' VAL . 0.4 OUTLIER 53.91 18.52 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.121 -0.987 . . . . 0.0 110.074 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -132.85 3.42 4.94 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.4 t -79.31 116.3 19.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.176 -1.191 . . . . 0.0 110.178 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.716 ' O ' HG23 ' A' ' 36' ' ' THR . 1.4 t-20 -85.38 54.85 3.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 110.368 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER 178.41 48.15 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.313 -0.867 . . . . 0.0 110.237 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.7 p90 . . . . . 0 C--N 1.302 -1.467 0 CA-C-O 117.879 -1.057 . . . . 0.0 110.424 -179.937 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.296 0.57 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 52.1 t -64.42 -80.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.241 -0.912 . . . . 0.0 110.442 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 11.1 t-20 179.0 -35.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.651 ' HB ' HG22 ' A' ' 6' ' ' THR . 59.4 p -119.02 120.95 38.74 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -40.97 -25.18 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.953 -0.699 . . . . 0.0 109.544 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.651 HG22 ' HB ' ' A' ' 4' ' ' THR . 9.0 t -74.67 -35.73 62.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.412 -0.805 . . . . 0.0 109.91 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.6 t -80.07 -56.64 4.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.435 -0.791 . . . . 0.0 109.823 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -47.17 -62.86 1.22 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.119 -0.988 . . . . 0.0 108.768 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 58.4 p -52.93 -36.83 60.25 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.483 178.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 2.7 mm-40 -60.35 -32.69 71.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.78 -1.2 . . . . 0.0 110.232 179.473 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.506 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -91.76 -46.35 7.94 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.703 1.24 . . . . 0.0 107.805 179.784 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 4.9 mp -61.9 -57.47 11.64 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.048 178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 9' ' ' THR . . . -59.17 -26.45 64.78 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.591 ' O ' ' CG ' ' A' ' 18' ' ' HIS . 16.7 t-20 -47.98 -50.19 28.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 19' ' ' SER . 0.7 OUTLIER -92.96 -25.28 18.08 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.548 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.0 -37.96 75.83 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.892 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.462 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 11.1 t -87.69 -30.69 5.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 O-C-N 121.199 -0.938 . . . . 0.0 109.155 179.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.591 ' CG ' ' O ' ' A' ' 14' ' ' ASN . 2.3 m80 -81.4 -47.12 13.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.6 -0.688 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -87.09 -31.81 20.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.128 -0.983 . . . . 0.0 111.7 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.613 ' O ' ' CE1' ' A' ' 23' ' ' PHE . 0.1 OUTLIER -91.89 -40.08 11.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.088 . . . . 0.0 111.908 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 17' ' ' VAL . 5.7 t-20 -83.69 -10.98 57.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.887 -1.133 . . . . 0.0 111.657 -178.578 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.542 ' O ' HG12 ' A' ' 26' ' ' ILE . 11.2 t-20 -55.57 -55.97 25.74 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.924 -1.11 . . . . 0.0 110.926 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.613 ' CE1' ' O ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -48.8 -21.5 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.052 -1.03 . . . . 0.0 110.346 -179.61 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.558 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.36 -47.61 3.74 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -64.93 -20.82 66.66 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -1.135 . . . . 0.0 111.128 -179.154 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 22' ' ' ASN . 15.9 mm -92.56 -35.18 6.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 120.878 -1.139 . . . . 0.0 108.349 179.14 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 23' ' ' PHE . 10.7 mt -50.19 -27.49 5.98 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 176.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.1 m -56.26 -23.17 34.61 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.875 0.845 . . . . 0.0 108.818 177.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.743 ' O ' HG22 ' A' ' 30' ' ' THR . 10.3 m -144.19 -76.77 0.23 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.809 -0.557 . . . . 0.0 109.531 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.743 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 67.31 -53.32 0.48 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 110.22 179.758 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.743 ' OD1' HG22 ' A' ' 30' ' ' THR . 13.0 p-10 -113.55 0.14 14.57 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.466 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 32' ' ' VAL . 0.5 OUTLIER 59.8 15.17 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.78 . . . . 0.0 110.345 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 114.79 113.79 2.99 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 33' ' ' GLY . 70.9 m -41.75 127.84 3.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.36 -1.082 . . . . 0.0 110.223 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -139.51 102.7 4.53 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.246 -0.909 . . . . 0.0 110.376 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.67 93.84 4.74 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -0.894 . . . . 0.0 109.846 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.509 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 6.9 p90 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.347 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.129 0.49 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.616 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 2.5 m -110.29 -108.43 0.34 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.144 -0.973 . . . . 0.0 110.105 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.616 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 6.5 t30 149.17 -28.18 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.701 ' HB ' HG22 ' A' ' 6' ' ' THR . 80.5 p -84.38 107.5 16.68 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.661 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -35.56 -30.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.35 0.595 . . . . 0.0 109.843 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.701 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.6 t -57.41 -45.93 84.03 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.584 ' N ' HG23 ' A' ' 6' ' ' THR . 37.9 t -89.14 -45.12 9.83 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -55.12 -54.3 44.92 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.541 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 28.2 m -57.81 -42.19 83.75 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.152 -0.967 . . . . 0.0 109.025 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 6' ' ' THR . 15.3 mm100 -71.74 -18.22 62.15 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.176 -0.952 . . . . 0.0 109.977 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.573 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -90.49 -49.86 6.27 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 178.757 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.545 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -56.7 -46.43 81.24 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.614 176.81 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -60.35 -32.22 71.06 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.485 0.66 . . . . 0.0 109.268 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 4.8 t-20 -57.88 -44.54 86.74 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.582 -0.699 . . . . 0.0 109.298 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.573 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 1.0 OUTLIER -87.82 -22.78 24.29 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.485 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -72.94 -53.15 12.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.251 -0.979 . . . . 0.0 109.19 179.724 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 48.3 t -66.49 -29.53 46.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.111 -0.993 . . . . 0.0 109.348 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.481 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 22.6 m170 -86.34 -57.82 2.86 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.351 -0.843 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.8 t -69.41 -26.66 64.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.466 -0.772 . . . . 0.0 111.664 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.585 ' O ' ' CD2' ' A' ' 23' ' ' PHE . 2.7 t -90.66 -46.49 8.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.032 -1.042 . . . . 0.0 110.892 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 39.6 t30 -64.75 -9.96 24.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.0 110.93 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' O ' ' N ' ' A' ' 25' ' ' ALA . 1.3 m-20 -51.95 -65.69 0.51 Allowed 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.064 -1.022 . . . . 0.0 111.428 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.585 ' CD2' ' O ' ' A' ' 20' ' ' SER . 7.9 p90 -47.33 -28.78 2.15 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.048 -1.032 . . . . 0.0 109.467 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.508 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -70.77 -38.18 66.4 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.704 -1.759 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.698 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -66.7 -9.99 42.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.434 -1.039 . . . . 0.0 109.785 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.817 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.1 mm -90.83 -48.08 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.9 mm? -49.11 -24.71 1.74 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.2 m -66.81 -3.72 7.48 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.95 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.537 ' C ' HG23 ' A' ' 30' ' ' THR . 26.4 m -116.61 33.04 5.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.995 -1.066 . . . . 0.0 110.939 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.537 HG23 ' C ' ' A' ' 29' ' ' SER . 67.4 p -151.5 -87.5 0.07 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.103 -0.998 . . . . 0.0 110.193 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.748 ' O ' HG12 ' A' ' 32' ' ' VAL . 26.1 t30 -87.47 -47.98 8.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.2 -0.937 . . . . 0.0 109.938 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.748 HG12 ' O ' ' A' ' 31' ' ' ASN . 6.8 p 41.84 25.81 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.667 -0.646 . . . . 0.0 110.445 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.494 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . 31.86 52.27 0.35 Allowed Glycine 0 N--CA 1.498 2.783 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.561 ' HB3' HG13 ' A' ' 32' ' ' VAL . 78.6 p -113.34 100.34 8.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.114 -1.227 . . . . 0.0 110.657 -179.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.623 ' C ' HG22 ' A' ' 36' ' ' THR . 2.7 p-10 179.15 48.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.135 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.623 HG22 ' C ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER 167.47 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.569 -0.707 . . . . 0.0 109.877 179.791 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.4 p90 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.089 -0.957 . . . . 0.0 110.062 -179.936 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.3 0.571 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.8 OUTLIER -58.08 -89.74 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.214 -0.929 . . . . 0.0 110.617 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.541 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.6 t-20 159.27 -28.39 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -179.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.634 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.4 p -94.92 112.76 24.45 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -38.48 -25.34 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.823 -0.548 . . . . 0.0 110.682 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.634 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.5 t -72.61 -33.96 67.05 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.873 -1.142 . . . . 0.0 109.221 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' ' O ' ' A' ' 4' ' ' THR . 36.8 t -89.72 -38.07 14.11 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.271 -0.893 . . . . 0.0 108.807 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.543 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -60.35 -56.5 20.7 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 5' ' ' ALA . 81.5 p -60.14 -38.32 82.75 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.363 -0.935 . . . . 0.0 108.948 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' THR . 4.2 tp60 -73.58 -19.83 60.77 Favored 'General case' 0 N--CA 1.486 1.342 0 O-C-N 121.225 -0.922 . . . . 0.0 110.201 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.0 tpm_? -90.71 -43.06 10.36 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.592 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -60.58 -41.14 94.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.493 177.135 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.593 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.44 -28.35 68.53 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.23 -47.9 77.55 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.592 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 7.0 m-85 -68.31 -21.35 64.77 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.593 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -64.47 -54.15 37.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.852 . . . . 0.0 109.727 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -72.77 -33.25 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.288 -0.883 . . . . 0.0 110.02 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -79.5 -58.47 3.19 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.138 -0.976 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.569 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 6.7 t -52.99 -22.95 6.32 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.001 -1.062 . . . . 0.0 110.077 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.599 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 31.5 t -81.68 -31.93 31.98 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -91.2 -22.35 20.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.3 -0.875 . . . . 0.0 109.992 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.557 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -57.86 -46.51 84.72 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.242 -0.911 . . . . 0.0 110.762 -179.534 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.599 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.4 OUTLIER -47.87 -23.06 0.66 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.379 -0.826 . . . . 0.0 110.107 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.582 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -78.92 -45.47 9.11 Favored Glycine 0 N--CA 1.487 2.058 0 N-CA-C 108.494 -1.842 . . . . 0.0 108.494 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.704 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -61.83 -11.43 12.55 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.411 -1.052 . . . . 0.0 110.215 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.805 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -91.94 -40.62 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 27' ' ' LEU . 12.1 mt -47.21 -28.43 1.88 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 176.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.487 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.9 m -59.29 -17.22 27.05 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.257 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.94 18.95 8.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.447 -0.783 . . . . 0.0 110.551 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.509 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 32.3 p -138.93 -76.04 0.37 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.271 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.685 ' O ' HG12 ' A' ' 32' ' ' VAL . 17.1 t-20 -53.41 -23.81 10.8 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 109.702 179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.685 HG12 ' O ' ' A' ' 31' ' ' ASN . 11.3 p 42.22 28.81 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 CA-C-O 121.652 0.739 . . . . 0.0 110.08 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 77.38 14.8 82.13 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 33' ' ' GLY . 54.2 p 42.35 -149.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.221 -1.164 . . . . 0.0 110.191 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -163.97 95.4 0.78 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.368 -0.833 . . . . 0.0 110.055 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.02 70.07 6.32 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.935 . . . . 0.0 110.218 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.549 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 35.5 p90 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.25 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.1 0.476 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.6 OUTLIER -107.31 -91.6 0.42 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.124 -0.985 . . . . 0.0 110.377 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.2 t-20 159.98 -27.22 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.583 ' OG1' HG22 ' A' ' 6' ' ' THR . 2.6 t -103.82 115.99 31.47 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.688 0.756 . . . . 0.0 109.972 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.874 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -39.73 -25.94 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.615 -0.678 . . . . 0.0 109.911 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.583 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.0 t -64.47 -39.8 94.49 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.553 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.2 t -89.72 -32.73 16.87 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.874 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -66.31 -49.38 67.24 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.0 m -59.71 -39.22 83.9 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 6' ' ' THR . 2.6 mt-30 -75.03 -20.01 59.78 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.501 -0.749 . . . . 0.0 109.519 178.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 7' ' ' CYS . 1.4 mmt85 -84.84 -41.93 15.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -59.04 -30.42 68.03 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.198 -1.365 . . . . 0.0 107.973 176.488 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.594 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.64 -35.24 78.53 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 122.003 0.906 . . . . 0.0 108.618 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -58.28 -45.64 87.55 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.1 m-85 -70.54 -19.94 62.85 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.0 OUTLIER -57.67 -32.32 67.2 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.6 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.6 -46.2 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.684 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 5.3 m-70 -69.7 -47.52 62.87 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.177 -0.952 . . . . 0.0 109.824 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.7 t -64.25 -56.14 16.67 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.239 -0.913 . . . . 0.0 109.112 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 82.1 p -46.71 -35.97 6.66 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.228 -0.92 . . . . 0.0 109.083 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.478 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -50.32 -26.19 4.57 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.047 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.814 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 28.9 m-20 -47.96 -25.08 1.23 Allowed 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.504 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ILE . 3.3 m-85 -56.82 -50.51 72.16 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -51.02 -31.13 24.82 Favored Glycine 0 N--CA 1.483 1.828 0 N-CA-C 107.284 -2.326 . . . . 0.0 107.284 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.814 ' HB3' ' O ' ' A' ' 22' ' ' ASN . . . -71.11 -24.16 62.24 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.729 -0.865 . . . . 0.0 109.598 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.681 ' N ' HD13 ' A' ' 26' ' ' ILE . 3.7 mm -91.8 -44.78 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.462 ' HG ' ' HB ' ' A' ' 36' ' ' THR . 7.4 mp -45.92 -28.64 1.17 Allowed 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.8 m -51.11 -52.52 42.91 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.584 0.707 . . . . 0.0 109.681 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.751 ' O ' HG22 ' A' ' 30' ' ' THR . 0.4 OUTLIER -79.5 -46.97 16.41 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.422 -0.799 . . . . 0.0 110.159 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.751 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 77.17 -15.13 0.77 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.718 -0.614 . . . . 0.0 110.707 179.889 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.416 ' C ' ' N ' ' A' ' 33' ' ' GLY . 0.9 OUTLIER -54.41 -14.86 1.36 Allowed 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.39 -0.819 . . . . 0.0 109.36 179.484 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.9 p -49.57 -17.48 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.905 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' N ' ' C ' ' A' ' 31' ' ' ASN . . . 154.66 39.71 0.02 OUTLIER Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 47.14 37.49 5.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.301 -1.117 . . . . 0.0 109.92 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 36' ' ' THR . 0.3 OUTLIER -133.25 -168.52 2.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.337 -0.852 . . . . 0.0 110.021 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.462 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 20.8 p 45.27 74.41 0.13 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.329 -0.857 . . . . 0.0 110.007 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.422 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 1.7 p90 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.221 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.314 0.578 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.509 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 13.2 m -133.8 -106.4 0.24 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 110.066 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.542 ' O ' ' CB ' ' A' ' 4' ' ' THR . 7.4 t-20 -137.96 25.18 2.78 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.767 -1.208 . . . . 0.0 109.714 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.724 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.5 m 80.03 -87.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.682 -0.636 . . . . 0.0 110.559 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -46.71 -20.9 0.15 Allowed 'General case' 0 C--N 1.293 -1.88 0 O-C-N 120.358 -1.464 . . . . 0.0 108.615 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.1 m -92.49 -65.66 0.98 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.458 -0.776 . . . . 0.0 110.647 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.509 ' SG ' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -67.49 -32.87 73.98 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.305 -0.872 . . . . 0.0 108.956 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.31 -55.03 17.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.402 -0.811 . . . . 0.0 109.015 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 79.5 m -57.95 -28.65 64.5 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.596 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 6' ' ' THR . 15.6 mm100 -88.49 -11.25 46.37 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 121.542 -0.724 . . . . 0.0 110.149 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 21.4 ttp180 -89.92 -48.35 7.28 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -61.52 -43.96 97.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.647 -1.16 . . . . 0.0 107.955 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.13 -22.48 66.94 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 21.8 t30 -58.17 -49.36 77.29 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 m-30 -63.82 -24.72 67.86 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -63.1 -49.92 72.53 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.397 179.377 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.2 t -81.46 -31.43 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.441 -0.787 . . . . 0.0 109.942 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 16.9 m170 -74.08 -57.12 4.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.412 -0.805 . . . . 0.0 110.187 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -69.48 -17.35 63.6 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.995 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.613 ' HA ' ' CE2' ' A' ' 23' ' ' PHE . 1.2 t -67.87 -48.16 66.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.383 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -67.74 -29.49 68.73 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.419 -0.8 . . . . 0.0 110.316 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.534 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -64.4 -65.68 0.64 Allowed 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.771 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.723 ' CD1' HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -68.01 -19.53 64.93 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.706 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.75 -32.32 54.15 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 108.284 -1.926 . . . . 0.0 108.284 178.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.716 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -73.98 -19.16 60.74 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.63 -0.924 . . . . 0.0 110.223 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.829 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -89.96 -48.51 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.723 HD22 ' CD1' ' A' ' 23' ' ' PHE . 4.8 mp -49.34 -24.86 2.07 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.477 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.7 m -73.96 3.88 6.19 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.722 179.073 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 26' ' ' ILE . 3.5 m -167.23 54.3 0.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.087 -1.008 . . . . 0.0 109.456 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.515 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -113.14 -82.09 0.59 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.475 -0.766 . . . . 0.0 110.438 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.515 ' H ' HG23 ' A' ' 30' ' ' THR . 30.3 t-20 -140.58 5.43 2.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -179.543 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.445 HG22 ' O ' ' A' ' 32' ' ' VAL . 8.9 p -70.79 -1.93 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.101 -0.999 . . . . 0.0 110.25 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' O ' ' A' ' 34' ' ' SER . . . 173.8 -72.37 0.09 OUTLIER Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.268 -1.533 . . . . 0.0 109.268 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.44 ' O ' ' O ' ' A' ' 33' ' ' GLY . 0.7 OUTLIER 57.29 113.91 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -1.09 . . . . 0.0 110.482 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.427 ' C ' ' OG1' ' A' ' 36' ' ' THR . 55.1 t30 -73.71 62.15 0.79 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.298 -0.876 . . . . 0.0 109.913 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.427 ' OG1' ' C ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -162.87 65.69 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.22 -0.925 . . . . 0.0 110.329 -179.633 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 p90 . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.161 179.909 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.41 0.624 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.3 OUTLIER -53.38 -83.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 0.0 110.624 -179.959 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.534 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 8.0 t-20 163.35 -27.58 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.432 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -120.8 121.69 38.72 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.636 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.55 -25.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.62 0.724 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.602 HG23 ' N ' ' A' ' 7' ' ' CYS . 8.0 t -78.75 -44.61 22.96 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.498 -0.751 . . . . 0.0 109.525 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.602 ' N ' HG23 ' A' ' 6' ' ' THR . 44.3 t -61.44 -47.16 87.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.463 -0.773 . . . . 0.0 109.185 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.577 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -56.95 -48.84 77.36 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.698 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 13' ' ' ALA . 17.5 m -63.11 -42.48 99.58 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.687 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 6' ' ' THR . 1.0 OUTLIER -66.29 -20.8 66.2 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.477 -0.764 . . . . 0.0 109.804 179.376 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -90.04 -48.87 6.92 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 178.551 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.577 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -58.77 -31.81 68.72 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.825 176.669 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.62 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.39 -27.99 61.77 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.796 0.808 . . . . 0.0 108.998 179.013 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 6.5 t-20 -60.45 -43.19 97.1 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.759 -0.588 . . . . 0.0 109.822 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.16 -16.53 33.13 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.162 179.923 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.3 mt -70.53 -49.29 49.69 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.815 -179.863 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.458 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 29.8 t -76.66 -36.43 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.413 -0.805 . . . . 0.0 109.852 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.538 ' HA ' ' HB2' ' A' ' 22' ' ' ASN . 10.8 m80 -77.93 -55.78 5.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.455 -0.778 . . . . 0.0 111.279 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' A' ' 23' ' ' PHE . 0.9 OUTLIER -75.76 -36.73 59.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.269 -0.894 . . . . 0.0 112.358 -178.047 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.4 OUTLIER -92.17 -40.9 10.75 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.758 -1.214 . . . . 0.0 112.456 -178.618 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.693 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -91.35 -38.65 12.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.995 -1.066 . . . . 0.0 112.83 -177.837 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.538 ' HB2' ' HA ' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -78.06 -41.14 36.46 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.798 -1.189 . . . . 0.0 111.667 -178.155 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.519 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 0.0 OUTLIER -59.46 -43.16 93.24 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.191 -0.943 . . . . 0.0 109.767 -179.6 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -84.05 -13.81 73.63 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.813 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.744 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -72.55 -27.94 62.53 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -1.1 . . . . 0.0 110.539 -179.718 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.86 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.6 mm -91.4 -47.73 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.413 ' N ' ' CD2' ' A' ' 27' ' ' LEU . 3.8 mm? -53.84 -22.01 8.79 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 176.036 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 24' ' ' GLY . 1.8 m -72.97 0.06 12.34 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.716 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -137.34 45.65 2.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.088 -1.007 . . . . 0.0 110.492 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.531 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 26.0 p -131.77 -75.83 0.51 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.434 -0.791 . . . . 0.0 110.283 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.531 ' N ' ' OG1' ' A' ' 30' ' ' THR . 1.4 p30 -87.04 -9.35 55.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.203 -0.936 . . . . 0.0 110.39 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.526 HG23 ' OD1' ' A' ' 31' ' ' ASN . 53.9 t -128.27 -76.5 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -0.868 . . . . 0.0 109.968 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.432 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . 41.15 38.35 1.8 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.465 ' H ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -178.63 -169.91 0.19 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.158 -1.201 . . . . 0.0 110.277 179.924 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.415 ' CB ' ' O ' ' A' ' 34' ' ' SER . 4.5 t-20 63.48 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.25 -0.906 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 36' ' ' THR . 6.7 t -126.16 78.84 1.8 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 109.947 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.4 p90 . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 117.889 -1.053 . . . . 0.0 110.384 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.2 0.524 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -139.64 -74.79 0.36 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.22 -0.925 . . . . 0.0 110.494 -179.634 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.4 t30 160.81 -33.62 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -179.373 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.538 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -100.2 119.33 38.2 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.963 178.377 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.52 -23.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.826 -0.546 . . . . 0.0 110.177 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.538 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -77.65 -41.22 39.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.143 -0.973 . . . . 0.0 109.519 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.499 ' N ' HG23 ' A' ' 6' ' ' THR . 38.3 t -86.13 -48.78 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.145 178.951 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -54.1 -53.31 54.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.025 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 52.3 m -54.33 -42.91 70.74 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.719 178.728 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -74.23 -18.81 60.69 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.312 -0.867 . . . . 0.0 110.653 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.3 mmt85 -90.1 -37.88 13.94 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.271 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -68.3 -31.64 71.23 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.276 177.974 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.83 -32.45 67.55 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.758 0.79 . . . . 0.0 108.869 178.82 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 18.0 t30 -59.04 -44.02 91.72 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.424 0.63 . . . . 0.0 109.644 179.314 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -79.78 -16.93 54.6 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.168 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -68.29 -54.9 14.33 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.541 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -78.44 -19.86 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.332 -0.855 . . . . 0.0 110.105 179.652 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 15.1 m170 -88.6 -56.98 3.08 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.036 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.6 p -62.2 -21.03 64.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.432 -0.792 . . . . 0.0 110.587 -179.624 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.591 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 22.8 t -90.79 -37.48 13.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.075 -1.015 . . . . 0.0 110.37 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 24' ' ' GLY . 16.9 t-20 -85.73 -4.7 59.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.339 -0.85 . . . . 0.0 110.535 -179.737 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 21' ' ' ASN . 8.1 t-20 -44.86 -52.67 8.33 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.224 -0.923 . . . . 0.0 109.784 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.631 ' O ' HD13 ' A' ' 27' ' ' LEU . 5.1 p90 -49.61 -29.94 7.97 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.455 -0.778 . . . . 0.0 108.936 179.424 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.624 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -79.6 -34.51 31.45 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.204 -1.558 . . . . 0.0 109.204 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.702 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -58.06 -18.51 25.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.291 -1.123 . . . . 0.0 109.783 179.738 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.789 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.3 mm -91.48 -42.07 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 179.403 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.631 HD13 ' O ' ' A' ' 23' ' ' PHE . 5.8 mp -52.39 -23.04 5.32 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.616 -1.254 . . . . 0.0 107.616 176.422 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.1 m -66.89 -12.42 59.3 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.51 179.595 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.404 ' C ' HG23 ' A' ' 30' ' ' THR . 0.4 OUTLIER -136.4 45.15 2.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.199 -0.938 . . . . 0.0 110.424 -179.612 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 26' ' ' ILE . 60.5 p -145.52 -76.5 0.21 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.427 -0.796 . . . . 0.0 109.855 179.888 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.473 ' N ' ' OG1' ' A' ' 30' ' ' THR . 6.5 p-10 -53.56 -24.69 14.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.303 -0.873 . . . . 0.0 109.641 179.644 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.29 -21.75 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.417 -0.802 . . . . 0.0 109.799 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 60.83 55.72 28.2 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.85 91.28 8.55 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.209 -1.171 . . . . 0.0 110.287 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.408 ' O ' ' HB ' ' A' ' 36' ' ' THR . 30.7 p30 -114.2 -176.23 2.85 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.059 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 35' ' ' ASN . 34.9 m 54.02 89.67 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.209 -0.932 . . . . 0.0 110.168 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.401 ' C ' ' O ' ' A' ' 36' ' ' THR . 52.2 p90 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.405 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.171 0.51 . . . . 0.0 110.129 . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.502 ' HB3' ' HB2' ' A' ' 8' ' ' ALA . 48.5 t -41.1 -79.06 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 6.9 t-20 169.78 -32.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 6' ' ' THR . 1.5 m -114.87 117.94 32.11 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.467 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.57 -25.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.69 -0.631 . . . . 0.0 110.043 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 4' ' ' THR . 3.0 t -75.48 -34.08 60.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.951 . . . . 0.0 110.368 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.3 t -89.9 -60.86 1.82 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.962 . . . . 0.0 109.641 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.753 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -44.97 -54.37 6.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.867 . . . . 0.0 109.206 179.136 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 27.9 m -59.78 -43.45 94.37 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.458 -0.776 . . . . 0.0 110.076 179.579 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.52 65.1 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 121.187 -0.946 . . . . 0.0 110.555 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.617 ' HG3' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.12 -50.07 6.05 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.114 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.753 HD12 ' C ' ' A' ' 8' ' ' ALA 0.262 3.2 mt -58.27 -39.75 80.07 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.25 178.101 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.8 -34.29 77.82 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.523 -0.736 . . . . 0.0 109.429 179.246 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.507 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 7.4 t30 -56.24 -44.57 79.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.403 -0.81 . . . . 0.0 109.349 179.393 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.621 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -85.44 -20.03 30.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.919 . . . . 0.0 108.877 179.568 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.539 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.0 tp -66.13 -52.71 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.823 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 t -72.1 -30.88 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.163 -0.961 . . . . 0.0 110.29 179.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 19.5 m-70 -89.8 -66.71 0.9 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.995 . . . . 0.0 110.878 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.2 t -50.95 -23.69 3.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 111.284 -178.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 9.1 p -90.78 -46.89 7.96 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.863 -1.148 . . . . 0.0 111.43 -179.337 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -84.47 -43.98 14.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.138 -0.976 . . . . 0.0 111.396 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 26' ' ' ILE . 5.2 t30 -65.41 -12.46 52.53 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.221 -0.924 . . . . 0.0 111.523 -178.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.579 ' O ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -76.65 -65.95 0.87 Allowed 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.927 -1.108 . . . . 0.0 110.612 -179.239 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -57.94 -22.16 47.44 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.517 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -70.39 -41.72 72.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 110.741 -179.638 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.606 HG22 HG21 ' A' ' 30' ' ' THR . 7.7 mm -91.64 -42.28 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.065 -1.022 . . . . 0.0 108.779 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.579 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.9 mm? -46.63 -26.98 1.01 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 176.726 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.2 m -61.79 -22.61 65.59 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.779 178.845 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.515 ' C ' HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -134.74 44.86 2.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.94 . . . . 0.0 110.545 -178.964 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.606 HG21 HG22 ' A' ' 26' ' ' ILE . 70.1 p -150.31 -55.51 0.16 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 110.041 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -54.25 -19.85 5.99 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.39 -0.819 . . . . 0.0 109.52 179.458 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.6 p -55.1 -19.59 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.853 0.835 . . . . 0.0 109.326 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.51 -29.07 6.43 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.0 p 44.32 73.98 0.14 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -1.09 . . . . 0.0 110.304 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -154.01 52.49 0.69 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.185 -0.947 . . . . 0.0 110.509 179.783 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 48.71 1.69 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.29 -0.881 . . . . 0.0 110.401 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.301 -1.503 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.258 -179.997 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.686 ' HB2' ' N ' ' A' ' 7' ' ' CYS . 5.4 p 169.63 114.75 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.509 -0.745 . . . . 0.0 109.02 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.693 ' O ' ' CB ' ' A' ' 4' ' ' THR . 6.8 t30 -100.52 15.26 28.56 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 112.385 -178.443 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.78 HG22 ' N ' ' A' ' 5' ' ' ALA . 1.8 m 139.52 -87.88 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 118.686 0.676 . . . . 0.0 110.638 178.583 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.78 ' N ' HG22 ' A' ' 4' ' ' THR . . . -43.53 -22.93 0.05 Allowed 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.567 -1.333 . . . . 0.0 108.995 179.58 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.547 ' HB ' ' CB ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -92.68 -57.96 2.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.569 -0.707 . . . . 0.0 110.907 179.507 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.686 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -77.76 -37.34 49.3 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -179.794 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.748 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -62.56 -52.4 63.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.556 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 31.8 m -59.84 -26.42 65.8 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.06 -1.025 . . . . 0.0 109.267 179.136 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.5 OUTLIER -89.96 -17.81 27.22 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.441 -0.787 . . . . 0.0 110.69 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -91.2 -39.44 12.1 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.597 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.604 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 2.0 mt -61.96 -49.04 77.69 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.639 -1.164 . . . . 0.0 108.696 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 16' ' ' LEU . . . -65.31 -27.79 68.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 10' ' ' GLN . 26.4 t-20 -61.38 -46.48 90.01 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 3.9 m-85 -62.71 -21.41 65.76 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 178.159 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.468 ' CB ' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -65.77 -53.76 36.06 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.708 179.336 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -80.24 -24.01 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 109.902 179.669 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' O ' ' N ' ' A' ' 22' ' ' ASN . 11.0 m170 -85.63 -62.2 1.58 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.968 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.7 p -51.48 -38.59 54.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.192 -0.943 . . . . 0.0 109.749 179.802 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 45.3 t -65.05 -45.31 85.89 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.385 -0.822 . . . . 0.0 109.682 179.57 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.34 7.39 38.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.838 . . . . 0.0 110.057 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.463 ' O ' HG12 ' A' ' 26' ' ' ILE . 4.9 t30 -67.92 -60.71 2.3 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.295 -0.878 . . . . 0.0 110.298 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.692 ' HD1' HD22 ' A' ' 27' ' ' LEU . 4.8 p90 -53.26 -24.45 11.43 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.313 -0.867 . . . . 0.0 109.615 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.505 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -73.44 -36.97 54.11 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 179.488 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.682 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -69.22 -16.88 63.7 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.336 -1.096 . . . . 0.0 109.775 179.768 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.783 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.2 mm -91.88 -50.2 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.958 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.692 HD22 ' HD1' ' A' ' 23' ' ' PHE . 3.0 mp -50.56 -24.95 3.58 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.803 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.1 m -56.03 -23.44 33.16 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 121.388 0.613 . . . . 0.0 109.92 179.047 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.62 17.88 6.01 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.416 -0.802 . . . . 0.0 109.987 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.539 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 20.5 p -137.21 -75.15 0.41 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.258 -0.901 . . . . 0.0 110.342 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.539 ' N ' ' OG1' ' A' ' 30' ' ' THR . 5.6 p-10 -53.92 -19.89 5.25 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.178 -0.951 . . . . 0.0 109.445 179.668 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.435 ' HB ' ' O ' ' A' ' 28' ' ' SER . 24.9 t -115.26 -31.2 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.538 -0.727 . . . . 0.0 109.845 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.13 7.67 78.35 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.482 ' CB ' ' O ' ' A' ' 30' ' ' THR . 24.7 t -113.8 39.89 2.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.243 -1.151 . . . . 0.0 110.091 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.44 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.1 t-20 -78.17 151.64 33.13 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.274 -0.891 . . . . 0.0 110.424 -179.922 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.44 ' O ' ' O ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER 50.02 100.65 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.303 -0.873 . . . . 0.0 110.317 179.976 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.169 179.92 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 1.6 p -78.92 -106.09 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.15 -0.969 . . . . 0.0 110.121 179.59 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER 178.55 26.23 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.68 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.576 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER -144.69 95.8 2.76 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.962 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -33.14 -31.24 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.022 0.439 . . . . 0.0 110.416 -179.441 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.588 HG23 ' N ' ' A' ' 7' ' ' CYS . 7.2 t -62.32 -45.56 92.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.035 -1.041 . . . . 0.0 108.426 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.588 ' N ' HG23 ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.69 -55.98 11.1 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.71 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.534 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -50.85 -57.79 7.59 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.014 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.542 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 15.0 m -54.39 -36.45 63.93 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.326 -0.859 . . . . 0.0 109.553 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 34.7 tp60 -65.2 -32.05 73.54 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.297 -0.877 . . . . 0.0 110.319 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 15.0 tpp180 -87.07 -48.0 8.45 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 178.338 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 8' ' ' ALA . 2.1 mt -52.05 -37.57 54.1 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.011 176.541 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -58.42 -43.94 88.86 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.464 0.649 . . . . 0.0 109.586 179.156 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.461 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 2.3 t30 -49.28 -43.55 43.25 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.251 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.558 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 0.4 OUTLIER -90.2 -19.29 24.37 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.451 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -67.97 -36.54 80.24 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.345 -0.942 . . . . 0.0 109.45 -179.919 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.7 t -85.17 -34.26 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.366 -0.833 . . . . 0.0 108.849 178.729 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -78.98 -53.75 6.72 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.482 -0.761 . . . . 0.0 110.004 179.539 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 15.5 t -61.98 -39.62 92.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.907 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 12.9 t -56.51 -43.92 80.24 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.298 -0.876 . . . . 0.0 109.293 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -51.27 -42.31 61.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.699 0.761 . . . . 0.0 109.295 179.119 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.495 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -84.34 -45.69 12.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.499 -0.75 . . . . 0.0 109.863 179.594 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.507 ' HB3' ' HA ' ' A' ' 20' ' ' SER . 38.9 t80 -51.52 -25.3 6.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.52 -0.737 . . . . 0.0 109.853 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 27' ' ' LEU . . . -86.93 -39.32 7.55 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.529 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -58.54 -23.22 57.81 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.101 -1.235 . . . . 0.0 110.299 -179.834 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.601 ' N ' HD13 ' A' ' 26' ' ' ILE . 5.0 mm -91.76 -34.1 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.345 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.571 ' HA ' HG21 ' A' ' 30' ' ' THR . 0.1 OUTLIER -53.2 -20.32 3.88 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.267 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.1 m -71.07 1.41 5.81 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.91 179.464 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.78 52.15 1.1 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.167 -0.958 . . . . 0.0 109.3 -179.746 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.571 HG21 ' HA ' ' A' ' 27' ' ' LEU . 55.2 p -122.86 -74.7 0.61 Allowed 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.633 -0.667 . . . . 0.0 111.262 -178.704 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' OG1' ' A' ' 30' ' ' THR . 37.3 t30 -131.28 26.54 4.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.355 -0.841 . . . . 0.0 110.862 -179.327 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.535 HG22 ' H ' ' A' ' 34' ' ' SER . 3.7 p -50.06 -36.46 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.009 -1.057 . . . . 0.0 109.075 179.526 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 64.01 6.19 17.86 Favored Glycine 0 N--CA 1.493 2.492 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.074 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.535 ' H ' HG22 ' A' ' 32' ' ' VAL . 80.3 p 39.23 54.39 2.21 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.052 -1.264 . . . . 0.0 110.642 -179.998 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.532 ' O ' ' C ' ' A' ' 36' ' ' THR . 63.6 m-20 59.63 162.44 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.164 -0.96 . . . . 0.0 110.5 179.874 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 36' ' ' THR . 10.6 t 21.65 98.67 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 121.263 0.554 . . . . 0.0 111.847 -179.99 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.509 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 7.9 p90 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.303 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.222 0.534 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 14.8 t -147.12 -87.58 0.09 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.263 -0.898 . . . . 0.0 110.047 179.894 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 7.7 t-20 179.18 -5.74 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.195 -0.941 . . . . 0.0 111.708 179.836 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.852 ' OG1' HG22 ' A' ' 6' ' ' THR . 1.7 t 176.11 121.35 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.0 -1.062 . . . . 0.0 109.12 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.401 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -40.06 -17.09 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.799 -0.563 . . . . 0.0 111.597 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.852 HG22 ' OG1' ' A' ' 4' ' ' THR . 8.8 t -77.5 -30.52 53.04 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 120.853 -1.155 . . . . 0.0 108.033 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.611 ' HB3' HG23 ' A' ' 4' ' ' THR . 10.6 p -83.96 -36.3 23.34 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.961 179.249 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.647 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.581 -0.699 . . . . 0.0 109.673 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -75.54 -35.74 60.62 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.082 179.13 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.479 ' HB2' ' O ' ' A' ' 6' ' ' THR . 4.2 tp-100 -81.04 -19.77 43.11 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.38 -0.825 . . . . 0.0 110.955 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 10.9 tpp180 -87.49 -41.92 13.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 178.94 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 8' ' ' ALA . 2.2 mm? -56.09 -31.57 63.35 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.396 176.649 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.616 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.07 -33.18 73.14 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.766 0.793 . . . . 0.0 109.097 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.09 -47.45 81.01 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.597 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 2.9 m-85 -70.44 -22.78 62.67 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.465 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.5 tp -51.16 -34.02 29.54 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 178.922 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 20' ' ' SER . 86.2 t -90.97 -55.33 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 119.966 -0.694 . . . . 0.0 110.112 179.002 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.472 ' O ' ' OD1' ' A' ' 21' ' ' ASN . 10.8 m170 -61.3 -39.56 90.91 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.23 -0.919 . . . . 0.0 110.391 -179.951 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -80.61 -31.39 36.67 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.406 -0.809 . . . . 0.0 108.819 179.249 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -45.28 -43.57 10.7 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.04 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.49 ' OD1' ' N ' ' A' ' 22' ' ' ASN . 10.6 p-10 -44.84 -32.15 1.47 Allowed 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.49 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 3.3 t-20 -80.43 -51.35 8.93 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.209 178.993 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.737 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -54.48 -32.48 57.88 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.529 -0.732 . . . . 0.0 109.052 179.037 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.453 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -84.74 -19.58 59.54 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.732 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -67.84 -25.17 65.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -1.108 . . . . 0.0 109.733 179.657 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.835 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.7 mm -91.42 -37.3 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.005 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.737 HD13 ' O ' ' A' ' 23' ' ' PHE . 7.6 mp -70.56 -6.56 37.36 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 175.728 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.657 ' O ' HG21 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -79.33 5.76 11.68 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.565 0.697 . . . . 0.0 109.43 178.632 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.98 33.9 3.86 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.252 -0.905 . . . . 0.0 108.681 179.691 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.711 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -168.28 -61.39 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.774 0.797 . . . . 0.0 110.74 -178.676 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.711 ' H ' HG23 ' A' ' 30' ' ' THR . 0.0 OUTLIER -72.25 1.97 6.79 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.584 -0.697 . . . . 0.0 109.989 179.914 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.657 HG21 ' O ' ' A' ' 28' ' ' SER . 6.5 t -74.3 11.48 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.12 -0.987 . . . . 0.0 110.454 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.89 32.88 3.39 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 179.502 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.7 28.24 6.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.113 -1.228 . . . . 0.0 109.766 179.762 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 51.49 58.17 5.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.477 -0.764 . . . . 0.0 110.178 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.785 HG22 ' O ' ' A' ' 36' ' ' THR . 38.3 m -133.22 45.77 2.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.336 -0.853 . . . . 0.0 110.121 179.879 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.501 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 10.3 p90 . . . . . 0 C--N 1.302 -1.467 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.4 pttp . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.32 0.581 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 8' ' ' ALA . 38.0 t -59.38 -95.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.456 -0.778 . . . . 0.0 109.48 179.649 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 33.2 t30 178.7 -32.02 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.913 -1.117 . . . . 0.0 108.876 179.336 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.884 ' HB ' HG22 ' A' ' 6' ' ' THR . 2.9 p -126.4 119.52 27.49 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.228 179.208 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -45.22 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.179 -0.951 . . . . 0.0 110.993 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.884 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.0 t -86.06 -28.42 24.12 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.003 -1.061 . . . . 0.0 109.709 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' ALA . 14.8 p -88.67 -36.14 16.39 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.613 -0.68 . . . . 0.0 110.085 -179.455 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . . . -72.85 -61.09 1.93 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.511 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -56.72 -31.99 65.06 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.324 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -76.0 -24.89 55.34 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.784 -1.198 . . . . 0.0 110.591 -179.641 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.6 OUTLIER -91.15 -44.07 9.48 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.641 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -61.96 -43.19 99.35 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.568 178.003 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.512 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.35 -29.86 70.14 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.447 -0.783 . . . . 0.0 109.403 179.263 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.83 -44.02 97.69 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.55 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.0 OUTLIER -72.59 -20.84 61.23 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.787 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -61.76 -39.68 92.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.573 179.489 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -86.1 -44.85 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.787 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 17.6 m-70 -71.66 -51.22 24.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.537 -0.727 . . . . 0.0 110.997 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.568 ' HA ' ' HB2' ' A' ' 22' ' ' ASN . 1.9 t -67.43 -42.05 83.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.211 -0.931 . . . . 0.0 110.838 -179.411 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.624 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 3.3 m -49.38 -55.52 12.68 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.96 -1.087 . . . . 0.0 109.837 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.18 5.72 21.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.91 -1.119 . . . . 0.0 109.886 179.415 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 19' ' ' SER . 26.1 t-20 -74.96 -46.71 33.66 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 0.0 110.943 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.873 ' O ' HD22 ' A' ' 27' ' ' LEU . 3.0 p90 -49.11 -26.26 2.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.094 -1.004 . . . . 0.0 109.435 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.577 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -77.76 -41.94 18.17 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.064 -1.614 . . . . 0.0 109.064 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.55 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -67.98 -24.4 65.14 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.436 -1.037 . . . . 0.0 111.221 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.637 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.2 mm -91.73 -44.14 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 108.726 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.873 HD22 ' O ' ' A' ' 23' ' ' PHE . 1.3 mp -48.2 -26.45 1.94 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.982 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.2 m -59.84 -32.81 71.02 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.913 0.863 . . . . 0.0 108.889 178.335 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.645 ' O ' ' HB ' ' A' ' 30' ' ' THR . 20.6 m -138.68 -81.03 0.32 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.998 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.645 ' HB ' ' O ' ' A' ' 29' ' ' SER . 5.3 t 142.71 -44.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -179.868 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.605 ' N ' HG23 ' A' ' 30' ' ' THR . 1.6 p-10 -160.04 -16.17 0.06 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.292 179.611 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 88.6 t -66.67 -6.88 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.618 -1.301 . . . . 0.0 110.17 -179.483 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 34' ' ' SER . . . 114.56 114.64 3.06 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 3.0 m -55.56 -159.89 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.365 -1.079 . . . . 0.0 110.697 -179.663 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.485 ' CB ' ' O ' ' A' ' 34' ' ' SER . 1.4 t-20 69.16 129.2 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.331 -0.856 . . . . 0.0 110.202 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.564 ' O ' ' C ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -63.22 103.39 0.48 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.211 -0.93 . . . . 0.0 110.234 -179.925 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.59 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 15.0 p90 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.641 179.613 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 121.269 0.557 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.8 OUTLIER -136.05 -84.47 0.37 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.14 -0.975 . . . . 0.0 110.694 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.5 t30 166.34 -28.13 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -179.516 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.55 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -72.78 105.12 4.21 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.604 0.716 . . . . 0.0 109.792 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.86 -22.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.307 -0.871 . . . . 0.0 110.923 179.513 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.595 HG23 ' N ' ' A' ' 7' ' ' CYS . 10.0 t -80.44 -38.13 30.68 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.01 -1.056 . . . . 0.0 108.16 179.122 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.595 ' N ' HG23 ' A' ' 6' ' ' THR . 11.7 p -82.18 -37.31 26.3 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.339 179.436 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.508 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -59.54 -64.32 0.99 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.344 -0.848 . . . . 0.0 108.783 178.909 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.2 m -53.05 -39.1 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.442 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 6' ' ' THR . 8.6 tt0 -68.53 -20.72 64.58 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 121.606 -0.683 . . . . 0.0 109.705 179.203 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 5.6 tpm_? -89.76 -49.15 6.8 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 105.769 -1.937 . . . . 0.0 105.769 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.2 mp -54.79 -35.93 64.37 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.36 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.95 -27.18 64.53 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.9 t-20 -58.75 -45.55 89.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.671 -0.643 . . . . 0.0 109.565 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.584 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 1.5 m-85 -77.64 -17.49 57.7 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.031 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 tp -66.99 -48.27 68.96 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.433 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.536 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 57.2 t -87.03 -35.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.0 109.983 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 26.5 m170 -67.48 -49.42 63.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.154 -0.966 . . . . 0.0 110.048 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 8.9 t -73.68 -25.91 60.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -0.872 . . . . 0.0 110.385 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 39.2 t -89.74 -36.06 15.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.0 110.346 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.536 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 7.2 t-20 -61.68 -22.57 65.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.93 . . . . 0.0 110.036 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -52.45 -71.1 0.07 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.995 -1.065 . . . . 0.0 110.214 -179.955 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' CE2' ' O ' ' A' ' 20' ' ' SER . 9.2 p90 -62.07 -26.83 68.5 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.163 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.07 -28.57 60.19 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.096 -1.602 . . . . 0.0 109.096 179.455 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.702 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -68.87 -25.57 64.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.336 -1.096 . . . . 0.0 109.613 179.548 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.816 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.0 mm -90.36 -42.47 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.398 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HA ' ' CG2' ' A' ' 30' ' ' THR 0.255 0.1 OUTLIER -55.51 -20.43 12.9 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 176.03 . . . . . . . . 4 4 . 1 . 028 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.0 m -76.34 9.91 2.35 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.885 179.607 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 m -161.79 46.45 0.17 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.895 -1.128 . . . . 0.0 110.532 -179.64 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.562 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 3.2 p -88.83 -66.31 0.93 Allowed 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.788 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -88.04 -8.77 55.08 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.74 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 31' ' ' ASN . 6.1 p 43.45 35.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.865 0.841 . . . . 0.0 109.801 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . 52.49 54.59 26.58 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.38 87.9 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.221 -1.164 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 33' ' ' GLY . 0.8 OUTLIER -115.25 58.49 0.72 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.303 -0.873 . . . . 0.0 110.595 -179.531 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 36' ' ' THR . 2.9 t -55.92 108.44 0.45 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.084 -1.01 . . . . 0.0 109.846 179.677 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.461 ' C ' ' O ' ' A' ' 36' ' ' THR . 15.7 p90 . . . . . 0 N--CA 1.497 1.909 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.686 -179.757 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.193 0.521 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 29.0 m -152.26 -91.48 0.05 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.193 -0.942 . . . . 0.0 110.397 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.55 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.9 t30 158.79 -24.11 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -179.443 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.615 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.8 OUTLIER -122.18 118.64 29.09 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.34 0.591 . . . . 0.0 109.411 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.557 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.28 -27.47 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 CA-C-O 121.108 0.48 . . . . 0.0 110.003 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.615 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.6 t -62.1 -39.33 92.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.979 . . . . 0.0 108.709 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.9 t -86.49 -48.6 8.25 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.673 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -57.45 -56.69 18.59 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.547 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.557 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 88.8 m -48.75 -44.21 38.41 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.821 -1.152 . . . . 0.0 108.224 178.456 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -63.01 -22.93 67.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.356 -0.84 . . . . 0.0 109.676 178.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 8' ' ' ALA . 0.4 OUTLIER -88.34 -45.08 10.31 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 178.792 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.579 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 3.8 mm? -56.61 -41.77 77.63 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.578 176.558 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.83 -31.79 72.87 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.783 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -53.15 -44.91 68.15 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.63 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.579 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 1.1 m-85 -67.1 -24.52 65.94 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.192 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -67.39 -40.87 85.68 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.176 179.722 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.461 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 20.9 t -77.17 -33.31 20.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 O-C-N 121.352 -0.843 . . . . 0.0 109.394 179.131 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 7.6 m170 -86.49 -63.53 1.3 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.447 -0.783 . . . . 0.0 110.294 179.944 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 t -49.2 -33.5 12.56 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.416 -0.803 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.609 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 7.3 t -85.46 -21.95 28.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.323 -0.861 . . . . 0.0 108.818 178.958 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 24' ' ' GLY . 1.1 m-20 -71.15 -17.72 62.53 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.019 179.397 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.438 ' C ' ' O ' ' A' ' 21' ' ' ASN . 4.6 t-20 -39.88 -65.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.299 -0.876 . . . . 0.0 110.601 -179.938 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.609 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -53.29 -19.83 3.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.096 -1.002 . . . . 0.0 109.544 179.684 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.569 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -82.46 -34.96 21.47 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.655 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -62.85 -13.95 40.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.987 . . . . 0.0 109.112 178.952 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.611 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.8 mm -91.33 -40.3 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.581 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD12 ' HA2' ' A' ' 24' ' ' GLY . 11.8 mt -48.06 -27.77 2.48 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 176.885 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.509 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 2.3 m -50.21 -30.8 12.35 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.968 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.773 ' C ' HG22 ' A' ' 30' ' ' THR . 2.4 m -124.19 -69.27 0.82 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 178.883 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.773 HG22 ' C ' ' A' ' 29' ' ' SER . 0.0 OUTLIER 163.73 -65.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.02 0.914 . . . . 0.0 109.345 179.113 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.75 ' H ' HG23 ' A' ' 30' ' ' THR . 3.3 p30 175.11 32.01 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.723 HG23 ' C ' ' A' ' 31' ' ' ASN . 2.6 t 76.55 48.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 121.299 0.571 . . . . 0.0 109.776 -178.755 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 34' ' ' SER . . . -151.92 41.77 0.72 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.894 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 56.5 m 56.0 -88.49 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.115 -1.227 . . . . 0.0 110.751 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.711 ' HB3' HG21 ' A' ' 30' ' ' THR . 0.2 OUTLIER 61.24 156.62 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.164 -0.96 . . . . 0.0 110.023 -179.751 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 36' ' ' THR . 3.4 t -51.06 88.25 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.278 -0.889 . . . . 0.0 110.313 -179.891 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.515 ' N ' ' O ' ' A' ' 35' ' ' ASN . 30.6 p90 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.278 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.234 0.54 . . . . 1.5 110.487 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 33.7 m -142.72 -111.98 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.371 -0.831 . . . . 1.5 109.834 179.671 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' A' ' 4' ' ' THR . 12.7 t-20 -155.87 15.35 0.35 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.917 -1.114 . . . . 3.2000000000000002 110.376 179.995 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.864 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 m 74.42 -82.37 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.126 -0.983 . . . . 2.5 110.17 -179.801 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.487 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -46.55 -20.35 0.12 Allowed 'General case' 0 C--N 1.296 -1.728 0 O-C-N 120.691 -1.255 . . . . 2.8999999999999999 108.565 178.114 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 4' ' ' THR . 18.9 m -90.92 -83.33 0.27 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.349 -0.844 . . . . 3.3999999999999999 110.322 179.658 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.496 ' N ' HG22 ' A' ' 6' ' ' THR . 1.3 m -60.39 -27.11 67.18 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.311 -0.868 . . . . 2.0 109.986 -179.819 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.864 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -77.54 -47.75 18.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.826 -1.15 . . . . 1.3999999999999999 109.618 179.572 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 30.9 m -66.87 -22.9 65.97 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.626 -1.23 . . . . 1.6000000000000001 108.891 179.017 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -86.44 -16.73 36.23 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.361 -0.837 . . . . 1.6000000000000001 109.259 179.024 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.57 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.23 -44.4 9.24 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.037 -1.838 . . . . 1.3 106.037 178.156 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 11.1 mt -66.27 -37.76 86.23 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.508 -1.224 . . . . 2.1000000000000001 109.188 177.834 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.94 -29.12 65.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 1.5 109.059 178.871 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.6 t-20 -60.66 -45.42 94.21 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 108.525 -0.917 . . . . 2.6000000000000001 108.525 179.027 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.57 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 3.0 m-85 -68.0 -20.49 65.03 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.893 -1.151 . . . . 2.1000000000000001 107.893 178.379 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.538 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.9 tp -60.0 -46.97 87.72 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.8 -0.76 . . . . 2.2999999999999998 109.334 179.302 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.1 -45.71 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.439 -0.788 . . . . 6.2000000000000002 110.454 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.465 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 7.2 m170 -64.14 -44.95 90.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.379 -0.825 . . . . 4.2000000000000002 110.766 -179.432 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -78.31 -40.42 36.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.243 -0.91 . . . . 9.0999999999999996 110.64 -179.397 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.9 t -46.45 -40.51 12.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 10.0 110.588 -179.688 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -90.4 -35.9 14.91 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.221 -0.924 . . . . 7.7000000000000002 111.402 -179.119 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.9 OUTLIER -78.39 -50.39 11.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.047 -1.033 . . . . 9.0999999999999996 110.783 -179.328 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -60.28 -21.83 62.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.304 -0.872 . . . . 9.0999999999999996 110.207 -179.611 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.85 -23.66 32.33 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.61 -1.396 . . . . 7.0999999999999996 109.61 -179.881 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.741 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -74.16 -24.29 59.38 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -1.14 . . . . 25.0 110.363 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ILE . . . . . 0.842 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -91.95 -44.84 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 107.921 -1.14 . . . . 5.9000000000000004 107.921 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -51.82 -23.76 5.17 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.115 -1.439 . . . . 5.9000000000000004 107.115 176.206 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.4 m -73.61 -5.15 38.54 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.349 -0.841 . . . . 30.0 110.152 179.237 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.8 m -168.41 62.43 0.06 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.17 -0.957 . . . . 16.699999999999999 110.661 -179.133 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.581 HG23 ' H ' ' A' ' 31' ' ' ASN . 1.5 t -123.33 -49.38 1.93 Allowed 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.381 -0.824 . . . . 11.1 109.587 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.796 ' O ' HG22 ' A' ' 32' ' ' VAL . 41.9 p-10 173.55 -24.63 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 116.035 -0.53 . . . . 16.699999999999999 110.082 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.796 HG22 ' O ' ' A' ' 31' ' ' ASN . 2.1 m 44.69 25.97 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.318 -0.863 . . . . 16.699999999999999 109.247 -178.905 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 31' ' ' ASN . . . 88.77 106.07 1.04 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.179 -1.568 . . . . 16.699999999999999 109.179 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -149.13 -36.51 0.17 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.028 -1.278 . . . . 12.5 110.911 -179.633 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -125.54 177.68 6.07 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 20.0 110.595 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 p -78.9 91.49 4.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.282 -0.886 . . . . 30.0 110.149 -179.987 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 18.3 p90 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 118.013 -0.994 . . . . 30.0 110.222 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.767 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.3 p . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.592 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -49.54 -18.5 0.43 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 120.35 -1.469 . . . . 0.0 108.112 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.489 ' N ' ' C ' ' A' ' 4' ' ' THR . 74.8 m -92.44 -71.42 0.65 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.385 -0.822 . . . . 0.0 110.04 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -34.56 76.16 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.553 -0.717 . . . . 0.0 109.225 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.79 -56.11 11.9 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.37 -0.932 . . . . 0.0 109.535 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.554 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 42.0 p -55.61 -27.66 50.73 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.036 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -33.0 71.81 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.488 -0.757 . . . . 0.0 110.068 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 tpp180 -87.38 -44.61 11.24 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.529 ' HB2' ' HA ' ' A' ' 9' ' ' THR . 6.6 mp -54.92 -34.05 62.78 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.598 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.65 -30.69 68.45 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.764 0.793 . . . . 0.0 109.241 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.13 -40.89 82.43 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.405 -0.81 . . . . 0.0 109.269 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.533 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.4 m-85 -83.64 -16.11 46.39 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.565 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 mt -68.39 -49.7 58.2 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.421 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 22.7 t -76.32 -25.51 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.426 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -89.44 -57.94 2.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.214 -0.929 . . . . 0.0 110.629 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.6 t -54.92 -33.43 62.13 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.416 -0.802 . . . . 0.0 111.852 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 O-C-N 120.763 -1.211 . . . . 0.0 111.532 -178.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.594 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.7 m . . . . . 0 C--O 1.213 -0.84 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -34.98 -25.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 120.908 0.385 . . . . 0.0 110.985 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.594 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.0 t -74.0 -40.21 63.09 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 120.946 -1.096 . . . . 0.0 109.479 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' N ' ' O ' ' A' ' 4' ' ' THR . 21.2 t -74.42 -59.77 2.58 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.209 -0.932 . . . . 0.0 109.387 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.605 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -49.89 -46.78 52.09 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.969 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.508 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 6.8 m -57.31 -43.65 83.47 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.165 -0.959 . . . . 0.0 109.184 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.443 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -64.24 -25.38 68.04 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.399 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.11 -43.01 11.37 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.605 HD23 ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -61.38 -30.38 70.5 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.88 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.608 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -68.22 -37.8 81.23 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.755 0.788 . . . . 0.0 109.279 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -41.33 85.42 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.651 -0.656 . . . . 0.0 109.526 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -79.92 -22.05 43.19 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -60.3 -36.71 78.5 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.164 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.0 t -90.49 -33.36 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.774 . . . . 0.0 109.952 179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -80.89 -36.85 30.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.277 -0.89 . . . . 0.0 110.338 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 22.8 t -90.13 -40.45 12.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.118 -0.989 . . . . 0.0 112.302 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.498 1.94 0 O-C-N 120.809 -1.182 . . . . 0.0 112.892 -177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.846 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.2 p . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.521 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -46.12 -24.8 0.49 Allowed 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 118.299 -1.36 . . . . 0.0 107.918 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.497 HG22 ' N ' ' A' ' 7' ' ' CYS . 4.3 m -92.71 -76.79 0.46 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.581 -0.699 . . . . 0.0 109.812 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' N ' HG22 ' A' ' 6' ' ' THR . 10.9 m -60.16 -40.47 89.99 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.571 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.846 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -64.61 -48.72 73.86 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 118.886 -1.126 . . . . 0.0 108.919 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.3 m -51.15 -41.85 60.39 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 118.432 -1.307 . . . . 0.0 108.049 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ASN . 3.6 tp60 -65.52 -21.68 66.64 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 121.446 -0.784 . . . . 0.0 110.661 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.588 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.08 -50.87 5.61 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 179.201 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -42.18 98.54 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.762 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -68.77 -27.52 65.97 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.7 t30 -55.9 -41.11 74.01 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.588 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 2.2 m-85 -88.96 -16.92 30.58 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 tp -72.38 -41.42 66.35 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.354 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.4 t -86.17 -27.48 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.858 . . . . 0.0 109.738 179.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 12.7 m170 -84.06 -49.49 8.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.278 -0.889 . . . . 0.0 109.928 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 p -71.01 -24.54 62.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.302 -0.874 . . . . 0.0 110.645 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 11.3 t . . . . . 0 N--CA 1.492 1.629 0 O-C-N 121.106 -0.996 . . . . 0.0 110.394 179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.642 ' HB ' HG22 ' A' ' 6' ' ' THR . 75.9 p . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.468 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -42.23 -22.49 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.494 -0.754 . . . . 0.0 109.86 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.642 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.8 t -77.79 -29.3 50.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.0 109.884 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.9 t -89.31 -63.69 1.25 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.189 -0.944 . . . . 0.0 109.634 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.466 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -44.58 -51.49 8.94 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.355 -0.841 . . . . 0.0 108.995 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 99.0 m -57.65 -48.06 80.52 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.199 -0.938 . . . . 0.0 109.342 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.77 -17.41 64.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.243 -0.911 . . . . 0.0 110.63 179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.468 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 3.2 ttm180 -91.19 -43.24 9.97 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 3.9 mm? -66.2 -37.08 84.74 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.189 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.26 -29.54 66.35 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.541 -0.724 . . . . 0.0 109.192 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -60.78 -43.83 97.57 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.608 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.97 -23.56 31.0 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -58.71 -58.33 9.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.396 -0.815 . . . . 0.0 109.862 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.1 -32.53 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.373 -0.83 . . . . 0.0 110.299 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.475 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.8 m170 -81.47 -68.16 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.19 -0.944 . . . . 0.0 110.288 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 8.5 t -39.32 -40.17 0.75 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.004 -0.678 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 C--N 1.297 -1.707 0 O-C-N 120.951 -1.093 . . . . 0.0 109.969 179.931 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.8 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -44.93 -22.05 0.08 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.534 -1.354 . . . . 0.0 108.748 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.523 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -91.4 -75.29 0.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.328 -0.858 . . . . 0.0 110.941 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HB2' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -63.19 -25.9 68.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.912 -1.117 . . . . 0.0 109.49 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.8 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -70.65 -56.99 5.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.741 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 44.5 p -56.58 -28.27 59.87 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.386 -1.326 . . . . 0.0 107.902 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 4.5 mm100 -78.28 -22.15 48.68 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.553 0.692 . . . . 0.0 109.616 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.07 -42.04 13.37 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.621 HD23 ' O ' ' A' ' 8' ' ' ALA . 3.7 mm? -57.3 -45.05 84.52 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.55 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.9 -22.28 65.09 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -63.88 -45.31 89.97 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.589 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 9.0 m-85 -65.94 -23.41 66.6 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -55.35 -40.27 71.06 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.9 t -85.65 -44.97 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 120.109 -0.637 . . . . 0.0 109.955 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.435 ' HB2' ' HA ' ' A' ' 15' ' ' PHE . 21.9 m-70 -66.84 -50.03 63.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.217 -0.927 . . . . 0.0 109.693 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.2 t -55.51 -53.34 57.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 0.0 109.711 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 t . . . . . 0 N--CA 1.49 1.548 0 O-C-N 121.374 -0.828 . . . . 0.0 109.9 179.682 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.611 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -40.41 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.651 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.611 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.7 t -67.36 -39.13 85.68 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 108.782 178.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.6 t -79.25 -47.61 15.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.25 77.37 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 18.7 m -56.14 -39.61 72.53 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -69.1 -19.25 64.05 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.65 0.738 . . . . 0.0 109.418 178.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 1.7 mmm180 -87.61 -51.28 5.98 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 105.264 -2.124 . . . . 0.0 105.264 177.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.918 ' O ' HD13 ' A' ' 16' ' ' LEU . 10.6 mt -56.08 -29.94 61.29 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.648 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.78 -26.1 62.29 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 30.6 t-20 -58.94 -46.76 87.19 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CB ' ' A' ' 19' ' ' SER . 2.1 m-85 -76.94 -21.18 55.19 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.918 HD13 ' O ' ' A' ' 12' ' ' LEU . 4.9 mp -67.33 -67.58 0.44 Allowed 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.176 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 71.8 t -58.63 -26.31 30.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 110.445 179.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 31.3 m-70 -88.56 -52.8 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.187 -0.946 . . . . 0.0 111.298 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.0 p -68.81 -32.62 72.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.281 -0.887 . . . . 0.0 110.145 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 59.7 m . . . . . 0 N--CA 1.489 1.518 0 O-C-N 120.997 -1.065 . . . . 0.0 109.1 179.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.548 ' CB ' HG22 ' A' ' 6' ' ' THR . 14.7 p . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.499 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -39.88 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.679 -0.638 . . . . 0.0 109.555 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.548 HG22 ' CB ' ' A' ' 4' ' ' THR . 6.1 t -64.37 -42.45 96.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' CG2' ' A' ' 6' ' ' THR . 5.3 t -84.12 -42.99 15.46 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.461 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -60.82 -53.38 58.06 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.499 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 85.3 m -55.55 -38.59 69.5 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.875 -1.13 . . . . 0.0 108.147 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -71.13 -21.26 62.22 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.846 0.832 . . . . 0.0 109.394 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -87.01 -43.03 12.65 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' O ' HD23 ' A' ' 16' ' ' LEU . 2.3 mm? -57.57 -39.57 77.03 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.791 176.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.82 -28.34 67.48 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.63 -43.32 97.65 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.507 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -75.81 -17.85 59.7 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.045 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.7 OUTLIER -67.11 -38.66 86.01 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.591 -0.844 . . . . 0.0 108.978 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.7 t -86.41 -29.2 5.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.592 -0.692 . . . . 0.0 109.335 179.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -85.1 -51.56 6.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.369 -0.832 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.3 p -68.81 -39.92 79.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.812 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 7.8 t . . . . . 0 N--CA 1.489 1.478 0 O-C-N 121.192 -0.943 . . . . 0.0 110.037 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.539 ' CG2' HG22 ' A' ' 6' ' ' THR . 3.0 m . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.514 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.53 -24.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.264 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.576 HG23 ' N ' ' A' ' 7' ' ' CYS . 14.9 t -74.61 -40.77 61.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.211 -0.931 . . . . 0.0 109.372 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.576 ' N ' HG23 ' A' ' 6' ' ' THR . 9.4 t -77.31 -57.79 3.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.423 -0.798 . . . . 0.0 109.829 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.83 -46.27 51.0 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.385 -0.822 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 22.1 m -64.77 -44.16 90.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.818 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -78.15 -10.95 59.87 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.362 -0.836 . . . . 0.0 111.122 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.6 OUTLIER -91.38 -51.72 5.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 7.5 mt -58.51 -45.22 89.24 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.869 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.455 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . . . -64.52 -27.4 68.94 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 11' ' ' ARG . 20.1 t-20 -53.36 -46.92 69.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -90.68 -20.14 22.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.535 -0.728 . . . . 0.0 109.07 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -70.68 -40.4 72.95 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.507 -0.877 . . . . 0.0 109.629 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.1 t -84.64 -29.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.303 -0.873 . . . . 0.0 109.619 179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 9.9 m170 -85.86 -47.52 9.61 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.465 -0.772 . . . . 0.0 110.924 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -78.22 -22.95 47.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.244 -0.91 . . . . 0.0 111.692 -178.555 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 4.2 p . . . . . 0 N--CA 1.491 1.611 0 O-C-N 120.592 -1.318 . . . . 0.0 111.423 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.908 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.5 m . . . . . 0 N--CA 1.481 1.079 0 CA-C-O 120.557 0.218 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.542 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . -43.86 -21.92 0.05 OUTLIER 'General case' 0 C--N 1.295 -1.796 0 O-C-N 120.818 -1.176 . . . . 0.0 109.542 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.7 p -91.47 -85.84 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.134 -0.979 . . . . 0.0 110.595 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 6' ' ' THR . 2.1 m -55.82 -30.45 61.42 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.538 -0.726 . . . . 0.0 109.625 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.908 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -74.63 -58.9 2.99 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.114 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.816 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 1.5 t -50.67 -27.15 6.42 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 118.347 -1.341 . . . . 0.0 109.623 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -35.71 72.78 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 14.4 ttp180 -88.21 -39.73 14.25 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.1 mm? -64.24 -25.99 68.31 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.077 176.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.816 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -67.56 -43.18 81.28 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 121.725 0.774 . . . . 0.0 109.719 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.554 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 40.7 t30 -56.32 -42.66 78.01 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.561 0.696 . . . . 0.0 109.639 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -86.65 -12.98 46.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.636 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -69.5 -40.4 77.02 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.284 -0.966 . . . . 0.0 108.967 179.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 46.3 t -80.73 -33.06 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.297 -0.877 . . . . 0.0 109.256 179.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -81.97 -48.78 11.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.462 -0.774 . . . . 0.0 110.495 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.6 t -70.75 -50.4 36.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.212 -0.93 . . . . 0.0 110.794 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 3.4 t . . . . . 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.329 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -38.73 -28.98 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.51 0.672 . . . . 0.0 109.689 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 4' ' ' THR . 9.4 t -67.01 -44.91 79.1 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.629 ' N ' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -72.25 -39.08 68.71 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.097 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -62.45 -53.51 53.73 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 18.2 m -57.39 -33.81 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.518 ' NE2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.8 -27.73 66.13 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.47 -0.769 . . . . 0.0 109.803 179.273 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -87.56 -47.12 8.96 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -58.99 -22.57 60.76 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.146 176.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 16' ' ' LEU . . . -73.53 -37.71 65.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.885 0.85 . . . . 0.0 109.287 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -57.82 -42.5 84.43 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.582 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -81.64 -17.22 48.88 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.804 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 13' ' ' ALA . 5.6 mt -66.04 -61.04 2.26 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.85 -1.14 . . . . 0.0 108.508 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -56.34 -41.98 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.773 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -72.84 -56.67 4.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.39 -0.819 . . . . 0.0 110.528 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.571 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.4 t -65.6 -50.52 64.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.291 -0.88 . . . . 0.0 110.618 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 70.7 m . . . . . 0 N--CA 1.493 1.709 0 O-C-N 121.097 -1.002 . . . . 0.0 109.428 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.53 ' O ' ' N ' ' A' ' 7' ' ' CYS . 3.1 m . . . . . 0 N--CA 1.482 1.15 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.57 -27.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.337 0.589 . . . . 0.0 109.816 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.555 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 5.2 t -67.72 -45.08 76.09 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.219 -0.925 . . . . 0.0 108.619 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' CG2' ' A' ' 6' ' ' THR . 38.9 t -76.53 -49.97 15.11 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.318 -0.864 . . . . 0.0 108.733 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.479 ' O ' HD13 ' A' ' 12' ' ' LEU . . . -51.62 -51.07 58.6 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.478 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.7 m -59.71 -45.97 90.51 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.426 -0.796 . . . . 0.0 108.952 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.587 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -69.63 -13.17 62.17 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.155 -0.966 . . . . 0.0 109.96 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -91.1 -52.85 4.63 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 8' ' ' ALA . 4.1 mp -52.0 -42.43 63.0 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.61 -31.17 72.25 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 3.7 t-20 -53.26 -52.67 58.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.45 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 2.6 m-85 -60.92 -22.03 63.97 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.553 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.6 tp -75.77 -38.66 58.15 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.696 0.76 . . . . 0.0 109.149 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.421 HG23 ' O ' ' A' ' 13' ' ' ALA . 17.7 t -88.32 -36.35 9.11 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.235 -0.915 . . . . 0.0 109.366 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.4 m-70 -74.65 -52.85 10.57 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.13 -0.981 . . . . 0.0 111.153 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.93 -31.37 15.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.245 -0.909 . . . . 0.0 112.273 -178.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.553 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.75 0 O-C-N 120.746 -1.221 . . . . 0.0 112.648 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.643 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.1 OUTLIER . . . . . 0 C--O 1.21 -0.978 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -41.61 -23.32 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.5 t -72.32 -39.88 67.87 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 4' ' ' THR . 43.6 t -70.03 -40.26 75.29 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.75 -48.41 63.8 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.621 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 5.5 m -57.71 -32.63 67.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 4.9 tt0 -69.26 -25.19 64.14 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.74 0.781 . . . . 0.0 109.687 179.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -88.64 -53.55 4.58 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.288 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -50.3 -37.83 38.37 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 175.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.621 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -63.72 -31.45 72.62 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -50.98 -44.55 60.81 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.2 m-85 -91.59 -26.79 18.55 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -70.75 -43.87 67.93 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 118.619 -1.232 . . . . 0.0 108.693 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.9 t -73.51 -31.64 33.56 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.256 178.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -85.18 -36.56 20.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.416 -0.803 . . . . 0.0 110.693 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.5 t -89.4 -20.36 24.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.182 -0.949 . . . . 0.0 111.416 -178.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 20.2 m . . . . . 0 N--CA 1.495 1.794 0 O-C-N 120.758 -1.214 . . . . 0.0 110.641 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.75 ' CG2' HG22 ' A' ' 6' ' ' THR . 2.5 m . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.69 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.75 HG22 ' CG2' ' A' ' 4' ' ' THR . 8.9 t -73.76 -40.27 63.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.519 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.606 ' N ' HG23 ' A' ' 6' ' ' THR . 7.0 t -72.31 -54.42 9.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.608 -0.682 . . . . 0.0 109.91 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.22 -36.6 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 109.357 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 40.9 m -73.43 -42.98 61.35 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.404 -0.81 . . . . 0.0 109.381 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' ' 7' ' ' CYS . 3.9 pt20 -83.28 -5.26 59.07 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 121.362 -0.836 . . . . 0.0 110.472 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.527 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -90.43 -51.71 5.28 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -63.47 -49.33 74.06 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.035 176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.498 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.15 -21.79 65.34 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.56 ' OD1' ' CD2' ' A' ' 18' ' ' HIS . 4.1 t-20 -55.98 -59.59 4.69 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.6 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -57.26 -22.95 45.04 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.658 -1.217 . . . . 0.0 108.036 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -74.72 -41.24 60.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.64 -0.824 . . . . 0.0 109.28 179.117 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 6.9 t -90.33 -42.81 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.212 -0.93 . . . . 0.0 110.033 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.56 ' CD2' ' OD1' ' A' ' 14' ' ' ASN . 6.2 m-70 -67.67 -36.94 81.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.427 -0.796 . . . . 0.0 110.843 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -90.17 -42.64 10.94 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.348 -178.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.296 -1.737 0 O-C-N 121.02 -1.05 . . . . 0.0 112.9 -177.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.64 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -42.6 -16.59 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.316 -0.865 . . . . 0.0 111.365 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.64 HG22 ' HB ' ' A' ' 4' ' ' THR . 3.3 t -87.33 -30.41 20.85 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.027 -1.046 . . . . 0.0 108.285 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 11.8 p -85.12 -38.13 19.43 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -64.69 -46.92 80.34 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.3 p -58.79 -42.11 88.29 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 6' ' ' THR . 11.5 mm-40 -75.57 -13.93 60.37 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 121.507 0.67 . . . . 0.0 109.804 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 12.4 tpp180 -90.12 -43.09 10.7 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -62.27 -44.54 96.3 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.557 -1.201 . . . . 0.0 108.767 177.183 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.57 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.7 -25.6 67.39 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t30 -58.79 -44.35 90.7 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.89 -19.59 34.51 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.3 tp -71.87 -63.9 1.04 Allowed 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.218 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 64.3 t -61.44 -25.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.045 . . . . 0.0 109.697 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.521 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 16.0 m-70 -86.66 -53.03 5.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.251 -0.906 . . . . 0.0 110.648 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -79.56 -25.12 41.69 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.268 -0.895 . . . . 0.0 111.278 -178.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.6 t . . . . . 0 N--CA 1.494 1.761 0 O-C-N 121.02 -1.05 . . . . 0.0 110.847 -179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.714 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.7 OUTLIER . . . . . 0 N--CA 1.482 1.131 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.525 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.93 -21.29 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.714 HG22 ' OG1' ' A' ' 4' ' ' THR . 7.2 t -75.6 -37.74 59.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.093 -1.005 . . . . 0.0 109.644 179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.535 ' H ' HG23 ' A' ' 4' ' ' THR . 36.0 t -83.15 -62.52 1.57 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.747 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -43.22 -63.33 0.83 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.124 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.535 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 91.9 m -48.5 -42.05 31.74 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.793 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.541 ' HB2' ' O ' ' A' ' 6' ' ' THR . 6.2 tt0 -61.07 -31.6 71.26 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 121.044 -1.035 . . . . 0.0 110.949 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' CG ' ' CZ ' ' A' ' 15' ' ' PHE . 17.3 ttp85 -92.2 -44.98 8.48 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.833 -1.167 . . . . 0.0 107.853 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 5.5 mp -61.83 -45.77 92.39 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.538 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.74 -28.67 68.6 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -54.04 -42.61 69.4 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.32 -18.31 28.76 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.657 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 6.7 tp -71.76 -36.57 70.44 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.444 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 34.2 t -87.83 -35.52 8.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.166 -0.959 . . . . 0.0 109.347 178.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 6.9 m-70 -79.29 -48.54 13.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.412 -0.805 . . . . 0.0 111.211 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -90.13 -29.68 18.14 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.917 -1.114 . . . . 0.0 112.287 -178.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.747 0 O-C-N 120.695 -1.253 . . . . 0.0 111.971 -178.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.651 ' HB ' HG22 ' A' ' 6' ' ' THR . 59.4 p . . . . . 0 N--CA 1.484 1.231 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -40.97 -25.18 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.953 -0.699 . . . . 0.0 109.544 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.651 HG22 ' HB ' ' A' ' 4' ' ' THR . 9.0 t -74.67 -35.73 62.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.412 -0.805 . . . . 0.0 109.91 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.6 t -80.07 -56.64 4.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.435 -0.791 . . . . 0.0 109.823 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -47.17 -62.86 1.22 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.119 -0.988 . . . . 0.0 108.768 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 58.4 p -52.93 -36.83 60.25 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.483 178.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER -60.35 -32.69 71.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.78 -1.2 . . . . 0.0 110.232 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.506 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -91.76 -46.35 7.94 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.703 1.24 . . . . 0.0 107.805 179.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 4.9 mp -61.9 -57.47 11.64 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.048 178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 9' ' ' THR . . . -59.17 -26.45 64.78 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.591 ' O ' ' CG ' ' A' ' 18' ' ' HIS . 16.7 t-20 -47.98 -50.19 28.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 19' ' ' SER . 0.7 OUTLIER -92.96 -25.28 18.08 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.548 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.0 -37.96 75.83 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.892 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.442 ' CG2' ' HB1' ' A' ' 13' ' ' ALA . 11.1 t -87.69 -30.69 5.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 O-C-N 121.199 -0.938 . . . . 0.0 109.155 179.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.591 ' CG ' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -81.4 -47.12 13.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.6 -0.688 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -87.09 -31.81 20.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.128 -0.983 . . . . 0.0 111.7 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.548 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.088 . . . . 0.0 111.908 -179.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.701 ' HB ' HG22 ' A' ' 6' ' ' THR . 80.5 p . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.661 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -35.56 -30.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.35 0.595 . . . . 0.0 109.843 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.701 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.6 t -57.41 -45.93 84.03 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.584 ' N ' HG23 ' A' ' 6' ' ' THR . 37.9 t -89.14 -45.12 9.83 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -55.12 -54.3 44.92 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.541 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 28.2 m -57.81 -42.19 83.75 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.152 -0.967 . . . . 0.0 109.025 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 6' ' ' THR . 21.7 mm-40 -71.74 -18.22 62.15 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.176 -0.952 . . . . 0.0 109.977 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.573 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -90.49 -49.86 6.27 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 178.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.545 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -56.7 -46.43 81.24 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.614 176.81 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -60.35 -32.22 71.06 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.485 0.66 . . . . 0.0 109.268 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.569 ' O ' ' CD2' ' A' ' 18' ' ' HIS . 4.8 t-20 -57.88 -44.54 86.74 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.582 -0.699 . . . . 0.0 109.298 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.573 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 1.0 OUTLIER -87.82 -22.78 24.29 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.485 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -72.94 -53.15 12.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.251 -0.979 . . . . 0.0 109.19 179.724 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.49 -29.53 46.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.111 -0.993 . . . . 0.0 109.348 178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 14' ' ' ASN . 10.7 m-70 -86.34 -57.82 2.86 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.351 -0.843 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.8 t -69.41 -26.66 64.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.466 -0.772 . . . . 0.0 111.664 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.556 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.7 t . . . . . 0 N--CA 1.492 1.671 0 O-C-N 121.032 -1.042 . . . . 0.0 110.892 -179.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.634 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.4 p . . . . . 0 N--CA 1.481 1.084 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -38.48 -25.34 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.823 -0.548 . . . . 0.0 110.682 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.634 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.5 t -72.61 -33.96 67.05 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.873 -1.142 . . . . 0.0 109.221 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' ' O ' ' A' ' 4' ' ' THR . 36.8 t -89.72 -38.07 14.11 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.271 -0.893 . . . . 0.0 108.807 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.543 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -60.35 -56.5 20.7 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 5' ' ' ALA . 81.5 p -60.14 -38.32 82.75 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.363 -0.935 . . . . 0.0 108.948 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -73.58 -19.83 60.77 Favored 'General case' 0 N--CA 1.486 1.342 0 O-C-N 121.225 -0.922 . . . . 0.0 110.201 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.0 tpm_? -90.71 -43.06 10.36 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.592 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -60.58 -41.14 94.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.493 177.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.593 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.44 -28.35 68.53 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.23 -47.9 77.55 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.592 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 7.0 m-85 -68.31 -21.35 64.77 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.593 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -64.47 -54.15 37.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.852 . . . . 0.0 109.727 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -72.77 -33.25 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.288 -0.883 . . . . 0.0 110.02 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -79.5 -58.47 3.19 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.138 -0.976 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.569 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 6.7 t -52.99 -22.95 6.32 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.001 -1.062 . . . . 0.0 110.077 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.5 t . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.895 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.583 ' OG1' HG22 ' A' ' 6' ' ' THR . 2.6 t . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 121.688 0.756 . . . . 0.0 109.972 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.874 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -39.73 -25.94 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.615 -0.678 . . . . 0.0 109.911 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.583 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.0 t -64.47 -39.8 94.49 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.553 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.2 t -89.72 -32.73 16.87 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.874 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -66.31 -49.38 67.24 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.0 m -59.71 -39.22 83.9 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.9 OUTLIER -75.03 -20.01 59.78 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.501 -0.749 . . . . 0.0 109.519 178.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 7' ' ' CYS . 1.4 mmt85 -84.84 -41.93 15.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -59.04 -30.42 68.03 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.198 -1.365 . . . . 0.0 107.973 176.488 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.594 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.64 -35.24 78.53 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 122.003 0.906 . . . . 0.0 108.618 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -58.28 -45.64 87.55 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.1 m-85 -70.54 -19.94 62.85 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.0 OUTLIER -57.67 -32.32 67.2 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.6 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.6 -46.2 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.684 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -69.7 -47.52 62.87 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.177 -0.952 . . . . 0.0 109.824 179.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.7 t -64.25 -56.14 16.67 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.239 -0.913 . . . . 0.0 109.112 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 82.1 p . . . . . 0 N--CA 1.488 1.45 0 O-C-N 121.228 -0.92 . . . . 0.0 109.083 179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.724 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.5 m . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 110.559 -0.163 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -46.71 -20.9 0.15 Allowed 'General case' 0 C--N 1.293 -1.88 0 O-C-N 120.358 -1.464 . . . . 0.0 108.615 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.1 m -92.49 -65.66 0.98 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.458 -0.776 . . . . 0.0 110.647 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -67.49 -32.87 73.98 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.305 -0.872 . . . . 0.0 108.956 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.31 -55.03 17.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.402 -0.811 . . . . 0.0 109.015 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 79.5 m -57.95 -28.65 64.5 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.596 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 6' ' ' THR . 10.4 mm-40 -88.49 -11.25 46.37 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 121.542 -0.724 . . . . 0.0 110.149 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 21.4 ttp180 -89.92 -48.35 7.28 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -61.52 -43.96 97.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.647 -1.16 . . . . 0.0 107.955 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.13 -22.48 66.94 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 21.8 t30 -58.17 -49.36 77.29 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 m-30 -63.82 -24.72 67.86 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -63.1 -49.92 72.53 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.397 179.377 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.2 t -81.46 -31.43 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.441 -0.787 . . . . 0.0 109.942 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -74.08 -57.12 4.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.412 -0.805 . . . . 0.0 110.187 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -69.48 -17.35 63.6 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.995 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 1.2 t . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.383 179.77 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.166 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.55 -25.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.62 0.724 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.602 HG23 ' N ' ' A' ' 7' ' ' CYS . 8.0 t -78.75 -44.61 22.96 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.498 -0.751 . . . . 0.0 109.525 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.602 ' N ' HG23 ' A' ' 6' ' ' THR . 44.3 t -61.44 -47.16 87.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.463 -0.773 . . . . 0.0 109.185 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.577 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -56.95 -48.84 77.36 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.698 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 13' ' ' ALA . 17.5 m -63.11 -42.48 99.58 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -66.29 -20.8 66.2 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.477 -0.764 . . . . 0.0 109.804 179.376 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -90.04 -48.87 6.92 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 178.551 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.577 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -58.77 -31.81 68.72 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.825 176.669 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.62 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.39 -27.99 61.77 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.796 0.808 . . . . 0.0 108.998 179.013 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 6.5 t-20 -60.45 -43.19 97.1 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.759 -0.588 . . . . 0.0 109.822 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.16 -16.53 33.13 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.162 179.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.3 mt -70.53 -49.29 49.69 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.815 -179.863 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.66 -36.43 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.413 -0.805 . . . . 0.0 109.852 179.585 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 27.5 m-70 -77.93 -55.78 5.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.455 -0.778 . . . . 0.0 111.279 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -75.76 -36.73 59.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.269 -0.894 . . . . 0.0 112.358 -178.047 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.759 0 O-C-N 120.758 -1.214 . . . . 0.0 112.456 -178.618 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.538 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 108.963 -0.755 . . . . 0.0 108.963 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.52 -23.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.826 -0.546 . . . . 0.0 110.177 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.538 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -77.65 -41.22 39.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.143 -0.973 . . . . 0.0 109.519 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.499 ' N ' HG23 ' A' ' 6' ' ' THR . 38.3 t -86.13 -48.78 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.145 178.951 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -54.1 -53.31 54.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.025 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 52.3 m -54.33 -42.91 70.74 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.719 178.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -74.23 -18.81 60.69 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.312 -0.867 . . . . 0.0 110.653 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.3 mmt85 -90.1 -37.88 13.94 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -68.3 -31.64 71.23 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.276 177.974 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.83 -32.45 67.55 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.758 0.79 . . . . 0.0 108.869 178.82 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 18.0 t30 -59.04 -44.02 91.72 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.424 0.63 . . . . 0.0 109.644 179.314 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -79.78 -16.93 54.6 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.168 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -68.29 -54.9 14.33 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.541 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -78.44 -19.86 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.332 -0.855 . . . . 0.0 110.105 179.652 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 15.1 m170 -88.6 -56.98 3.08 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.036 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.6 p -62.2 -21.03 64.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.432 -0.792 . . . . 0.0 110.587 -179.624 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.489 1.525 0 O-C-N 121.075 -1.015 . . . . 0.0 110.37 -179.977 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 6' ' ' THR . 1.5 m . . . . . 0 N--CA 1.483 1.214 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.467 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.57 -25.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.69 -0.631 . . . . 0.0 110.043 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 4' ' ' THR . 3.0 t -75.48 -34.08 60.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.951 . . . . 0.0 110.368 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.3 t -89.9 -60.86 1.82 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.962 . . . . 0.0 109.641 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.753 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -44.97 -54.37 6.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.867 . . . . 0.0 109.206 179.136 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 27.9 m -59.78 -43.45 94.37 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.458 -0.776 . . . . 0.0 110.076 179.579 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.52 65.1 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 121.187 -0.946 . . . . 0.0 110.555 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.617 ' HG3' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.12 -50.07 6.05 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.114 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.753 HD12 ' C ' ' A' ' 8' ' ' ALA 0.262 3.2 mt -58.27 -39.75 80.07 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.25 178.101 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.8 -34.29 77.82 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.523 -0.736 . . . . 0.0 109.429 179.246 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.507 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 7.4 t30 -56.24 -44.57 79.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.403 -0.81 . . . . 0.0 109.349 179.393 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.621 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -85.44 -20.03 30.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.919 . . . . 0.0 108.877 179.568 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.539 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.0 tp -66.13 -52.71 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.823 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 t -72.1 -30.88 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.163 -0.961 . . . . 0.0 110.29 179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 19.5 m-70 -89.8 -66.71 0.9 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.995 . . . . 0.0 110.878 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.2 t -50.95 -23.69 3.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 111.284 -178.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 9.1 p . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.863 -1.148 . . . . 0.0 111.43 -179.337 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.78 HG22 ' N ' ' A' ' 5' ' ' ALA . 1.8 m . . . . . 0 N--CA 1.512 2.639 0 CA-C-O 120.754 0.312 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.78 ' N ' HG22 ' A' ' 4' ' ' THR . . . -43.53 -22.93 0.05 Allowed 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.567 -1.333 . . . . 0.0 108.995 179.58 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.2 OUTLIER -92.68 -57.96 2.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.569 -0.707 . . . . 0.0 110.907 179.507 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 11' ' ' ARG . 0.1 OUTLIER -77.76 -37.34 49.3 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -179.794 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.748 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -62.56 -52.4 63.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.556 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 31.8 m -59.84 -26.42 65.8 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.06 -1.025 . . . . 0.0 109.267 179.136 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -89.96 -17.81 27.22 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.441 -0.787 . . . . 0.0 110.69 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -91.2 -39.44 12.1 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.597 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.604 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 2.0 mt -61.96 -49.04 77.69 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.639 -1.164 . . . . 0.0 108.696 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 16' ' ' LEU . . . -65.31 -27.79 68.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 10' ' ' GLN . 26.4 t-20 -61.38 -46.48 90.01 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 3.9 m-85 -62.71 -21.41 65.76 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 178.159 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.468 ' CB ' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -65.77 -53.76 36.06 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.708 179.336 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -80.24 -24.01 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 109.902 179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 11.0 m170 -85.63 -62.2 1.58 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.968 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.7 p -51.48 -38.59 54.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.192 -0.943 . . . . 0.0 109.749 179.802 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.3 t . . . . . 0 N--CA 1.488 1.467 0 O-C-N 121.385 -0.822 . . . . 0.0 109.682 179.57 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.576 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.209 -1.036 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -33.14 -31.24 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.022 0.439 . . . . 0.0 110.416 -179.441 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.588 HG23 ' N ' ' A' ' 7' ' ' CYS . 7.2 t -62.32 -45.56 92.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.035 -1.041 . . . . 0.0 108.426 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.588 ' N ' HG23 ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.69 -55.98 11.1 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.71 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.534 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -50.85 -57.79 7.59 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.014 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.542 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 15.0 m -54.39 -36.45 63.93 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.326 -0.859 . . . . 0.0 109.553 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 3.3 tp-100 -65.2 -32.05 73.54 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.297 -0.877 . . . . 0.0 110.319 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 15.0 tpp180 -87.07 -48.0 8.45 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 178.338 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 8' ' ' ALA . 2.1 mt -52.05 -37.57 54.1 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.011 176.541 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -58.42 -43.94 88.86 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.464 0.649 . . . . 0.0 109.586 179.156 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.461 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 2.3 t30 -49.28 -43.55 43.25 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.251 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.558 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 0.4 OUTLIER -90.2 -19.29 24.37 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.451 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -67.97 -36.54 80.24 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.345 -0.942 . . . . 0.0 109.45 -179.919 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.7 t -85.17 -34.26 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.366 -0.833 . . . . 0.0 108.849 178.729 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -78.98 -53.75 6.72 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.482 -0.761 . . . . 0.0 110.004 179.539 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 15.5 t -61.98 -39.62 92.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.907 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 12.9 t . . . . . 0 N--CA 1.488 1.454 0 O-C-N 121.298 -0.876 . . . . 0.0 109.293 179.502 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.852 ' OG1' HG22 ' A' ' 6' ' ' THR . 1.7 t . . . . . 0 C--O 1.207 -1.157 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.401 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -40.06 -17.09 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.799 -0.563 . . . . 0.0 111.597 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.852 HG22 ' OG1' ' A' ' 4' ' ' THR . 8.8 t -77.5 -30.52 53.04 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 120.853 -1.155 . . . . 0.0 108.033 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.611 ' HB3' HG23 ' A' ' 4' ' ' THR . 10.6 p -83.96 -36.3 23.34 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.961 179.249 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.647 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.581 -0.699 . . . . 0.0 109.673 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -75.54 -35.74 60.62 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.082 179.13 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.519 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.2 tp60 -81.04 -19.77 43.11 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.38 -0.825 . . . . 0.0 110.955 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 10.9 tpp180 -87.49 -41.92 13.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 178.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 8' ' ' ALA . 2.2 mm? -56.09 -31.57 63.35 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.396 176.649 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.616 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.07 -33.18 73.14 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.766 0.793 . . . . 0.0 109.097 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.09 -47.45 81.01 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.597 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 2.9 m-85 -70.44 -22.78 62.67 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.465 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.5 tp -51.16 -34.02 29.54 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 178.922 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 20' ' ' SER . 86.2 t -90.97 -55.33 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 119.966 -0.694 . . . . 0.0 110.112 179.002 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.8 m170 -61.3 -39.56 90.91 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.23 -0.919 . . . . 0.0 110.391 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -80.61 -31.39 36.67 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.406 -0.809 . . . . 0.0 108.819 179.249 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.04 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.884 ' HB ' HG22 ' A' ' 6' ' ' THR . 2.9 p . . . . . 0 N--CA 1.483 1.212 0 CA-C-O 121.619 0.723 . . . . 0.0 109.228 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -45.22 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.179 -0.951 . . . . 0.0 110.993 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.884 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.0 t -86.06 -28.42 24.12 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.003 -1.061 . . . . 0.0 109.709 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' ALA . 14.8 p -88.67 -36.14 16.39 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.613 -0.68 . . . . 0.0 110.085 -179.455 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.533 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -72.85 -61.09 1.93 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.511 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -56.72 -31.99 65.06 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.324 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -76.0 -24.89 55.34 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.784 -1.198 . . . . 0.0 110.591 -179.641 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.6 OUTLIER -91.15 -44.07 9.48 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.641 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -61.96 -43.19 99.35 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.568 178.003 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.512 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.35 -29.86 70.14 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.447 -0.783 . . . . 0.0 109.403 179.263 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.83 -44.02 97.69 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.55 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.0 OUTLIER -72.59 -20.84 61.23 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.787 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -61.76 -39.68 92.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.573 179.489 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -86.1 -44.85 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.787 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 17.6 m-70 -71.66 -51.22 24.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.537 -0.727 . . . . 0.0 110.997 -179.718 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.55 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.9 t -67.43 -42.05 83.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.211 -0.931 . . . . 0.0 110.838 -179.411 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.571 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 3.3 m . . . . . 0 C--N 1.301 -1.511 0 O-C-N 120.96 -1.087 . . . . 0.0 109.837 -179.93 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.55 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 121.604 0.716 . . . . 0.0 109.792 . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.86 -22.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.307 -0.871 . . . . 0.0 110.923 179.513 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.595 HG23 ' N ' ' A' ' 7' ' ' CYS . 10.0 t -80.44 -38.13 30.68 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.01 -1.056 . . . . 0.0 108.16 179.122 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.595 ' N ' HG23 ' A' ' 6' ' ' THR . 11.7 p -82.18 -37.31 26.3 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.339 179.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.508 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -59.54 -64.32 0.99 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.344 -0.848 . . . . 0.0 108.783 178.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.2 m -53.05 -39.1 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.442 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -68.53 -20.72 64.58 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 121.606 -0.683 . . . . 0.0 109.705 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 5.6 tpm_? -89.76 -49.15 6.8 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 105.769 -1.937 . . . . 0.0 105.769 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.2 mp -54.79 -35.93 64.37 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.36 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.95 -27.18 64.53 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.9 t30 -58.75 -45.55 89.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.671 -0.643 . . . . 0.0 109.565 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.584 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 1.5 m-85 -77.64 -17.49 57.7 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.031 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 tp -66.99 -48.27 68.96 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.433 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.2 t -87.03 -35.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.0 109.983 179.457 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 26.5 m170 -67.48 -49.42 63.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.154 -0.966 . . . . 0.0 110.048 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 8.9 t -73.68 -25.91 60.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -0.872 . . . . 0.0 110.385 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 39.2 t . . . . . 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.0 110.346 -179.932 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.615 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.484 1.23 0 CA-C-O 121.34 0.591 . . . . 0.0 109.411 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.557 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.28 -27.47 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 CA-C-O 121.108 0.48 . . . . 0.0 110.003 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.615 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.6 t -62.1 -39.33 92.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.979 . . . . 0.0 108.709 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.9 t -86.49 -48.6 8.25 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.673 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -57.45 -56.69 18.59 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.547 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.557 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 88.8 m -48.75 -44.21 38.41 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.821 -1.152 . . . . 0.0 108.224 178.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -22.93 67.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.356 -0.84 . . . . 0.0 109.676 178.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 8' ' ' ALA . 0.4 OUTLIER -88.34 -45.08 10.31 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 178.792 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.579 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 3.8 mm? -56.61 -41.77 77.63 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.578 176.558 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.83 -31.79 72.87 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.15 -44.91 68.15 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.63 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.579 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 1.1 m-85 -67.1 -24.52 65.94 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.192 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -67.39 -40.87 85.68 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.176 179.722 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 20.9 t -77.17 -33.31 20.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 O-C-N 121.352 -0.843 . . . . 0.0 109.394 179.131 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 7.6 m170 -86.49 -63.53 1.3 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.447 -0.783 . . . . 0.0 110.294 179.944 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 t -49.2 -33.5 12.56 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.416 -0.803 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.535 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 7.3 t . . . . . 0 C--N 1.303 -1.424 0 O-C-N 121.323 -0.861 . . . . 0.0 108.818 178.958 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.864 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 m . . . . . 0 N--CA 1.485 1.3 0 N-CA-C 110.17 -0.307 . . . . 2.5 110.17 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.487 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -46.55 -20.35 0.12 Allowed 'General case' 0 C--N 1.296 -1.728 0 O-C-N 120.691 -1.255 . . . . 2.8999999999999999 108.565 178.114 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 4' ' ' THR . 18.9 m -90.92 -83.33 0.27 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.349 -0.844 . . . . 3.3999999999999999 110.322 179.658 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.496 ' N ' HG22 ' A' ' 6' ' ' THR . 1.3 m -60.39 -27.11 67.18 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.311 -0.868 . . . . 2.0 109.986 -179.819 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.864 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -77.54 -47.75 18.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.826 -1.15 . . . . 1.3999999999999999 109.618 179.572 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 30.9 m -66.87 -22.9 65.97 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.626 -1.23 . . . . 1.6000000000000001 108.891 179.017 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.516 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.6 mm-40 -86.44 -16.73 36.23 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.361 -0.837 . . . . 1.6000000000000001 109.259 179.024 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.57 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.23 -44.4 9.24 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.037 -1.838 . . . . 1.3 106.037 178.156 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 11.1 mt -66.27 -37.76 86.23 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.508 -1.224 . . . . 2.1000000000000001 109.188 177.834 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.94 -29.12 65.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 1.5 109.059 178.871 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.6 t-20 -60.66 -45.42 94.21 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 108.525 -0.917 . . . . 2.6000000000000001 108.525 179.027 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.57 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 3.0 m-85 -68.0 -20.49 65.03 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.893 -1.151 . . . . 2.1000000000000001 107.893 178.379 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.538 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.9 tp -60.0 -46.97 87.72 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.8 -0.76 . . . . 2.2999999999999998 109.334 179.302 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.1 -45.71 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.439 -0.788 . . . . 6.2000000000000002 110.454 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 7.2 m170 -64.14 -44.95 90.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.379 -0.825 . . . . 4.2000000000000002 110.766 -179.432 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -78.31 -40.42 36.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.243 -0.91 . . . . 9.0999999999999996 110.64 -179.397 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.9 t . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 10.0 110.588 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.192 0.52 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.444 ' HB2' ' H ' ' A' ' 7' ' ' CYS . 56.2 m -86.69 -82.48 0.2 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.079 -1.013 . . . . 0.0 109.457 179.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.754 ' C ' HG23 ' A' ' 4' ' ' THR . 0.3 OUTLIER -154.64 17.65 0.46 Allowed 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.417 -0.802 . . . . 0.0 109.426 179.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.767 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.3 p 75.88 -86.64 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.567 -0.708 . . . . 0.0 109.425 -179.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.592 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -49.54 -18.5 0.43 Allowed 'General case' 0 C--N 1.291 -1.945 0 O-C-N 120.35 -1.469 . . . . 0.0 108.112 177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.489 ' N ' ' C ' ' A' ' 4' ' ' THR . 74.8 m -92.44 -71.42 0.65 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.385 -0.822 . . . . 0.0 110.04 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.444 ' H ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -61.82 -34.56 76.16 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.553 -0.717 . . . . 0.0 109.225 179.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.767 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.79 -56.11 11.9 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 119.37 -0.932 . . . . 0.0 109.535 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.554 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 42.0 p -55.61 -27.66 50.73 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.65 -1.22 . . . . 0.0 109.036 179.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.77 -33.0 71.81 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.488 -0.757 . . . . 0.0 110.068 179.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 3.0 tpp180 -87.38 -44.61 11.24 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.529 ' HB2' ' HA ' ' A' ' 9' ' ' THR . 6.6 mp -54.92 -34.05 62.78 Favored 'General case' 0 C--N 1.293 -1.877 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.598 176.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.565 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.65 -30.69 68.45 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 121.764 0.793 . . . . 0.0 109.241 178.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -58.13 -40.89 82.43 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.405 -0.81 . . . . 0.0 109.269 179.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.533 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.4 m-85 -83.64 -16.11 46.39 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.565 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 mt -68.39 -49.7 58.2 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.392 -0.923 . . . . 0.0 109.421 179.427 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.466 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 22.7 t -76.32 -25.51 16.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.457 -0.777 . . . . 0.0 110.426 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.503 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 6.0 m170 -89.44 -57.94 2.7 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.214 -0.929 . . . . 0.0 110.629 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.6 t -54.92 -33.43 62.13 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.416 -0.802 . . . . 0.0 111.852 -179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -90.73 -34.92 15.18 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 120.763 -1.211 . . . . 0.0 111.532 -178.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.466 ' HB3' ' O ' ' A' ' 17' ' ' VAL . 57.6 t30 -78.71 -46.29 19.36 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.921 -1.112 . . . . 0.0 111.246 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.526 ' O ' HG12 ' A' ' 26' ' ' ILE . 1.0 OUTLIER -43.9 -24.61 0.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.217 -0.927 . . . . 0.0 111.026 -179.099 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.413 ' N ' ' O ' ' A' ' 21' ' ' ASN . 2.1 m-85 -66.29 -53.61 34.62 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.104 -0.998 . . . . 0.0 110.718 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.418 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -59.41 -19.42 47.29 Favored Glycine 0 N--CA 1.488 2.153 0 N-CA-C 108.302 -1.919 . . . . 0.0 108.302 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.759 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -78.77 -24.54 44.65 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.421 -1.047 . . . . 0.0 111.428 -179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.901 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.2 mm -90.91 -51.35 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.533 ' HA ' HD13 ' A' ' 27' ' ' LEU 0.255 2.6 mm? -49.89 -25.44 3.2 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 176.094 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.422 ' N ' ' C ' ' A' ' 26' ' ' ILE . 2.2 m -78.39 2.59 18.22 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.242 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.431 ' N ' ' O ' ' A' ' 26' ' ' ILE . 2.5 t -132.82 42.32 3.08 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.96 -1.088 . . . . 0.0 110.895 -179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.498 ' CG2' ' O ' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -121.13 -73.97 0.63 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.284 -0.885 . . . . 0.0 109.074 179.424 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.575 ' ND2' ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -73.51 -2.23 21.82 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 119.971 -0.692 . . . . 0.0 109.17 178.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 8.6 p -45.26 -20.24 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.173 -0.954 . . . . 0.0 110.088 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.514 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . -115.62 -22.88 4.58 Favored Glycine 0 N--CA 1.487 2.056 0 N-CA-C 109.912 -1.275 . . . . 0.0 109.912 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.478 ' CB ' ' O ' ' A' ' 33' ' ' GLY . 1.3 m 67.28 -61.16 0.36 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.254 -1.145 . . . . 0.0 109.883 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.514 ' N ' ' O ' ' A' ' 33' ' ' GLY . 2.6 t-20 -67.93 -170.68 0.18 Allowed 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.496 -0.753 . . . . 0.0 109.81 179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 m -63.08 102.22 0.35 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.222 -0.924 . . . . 0.0 110.042 179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.072 -0.965 . . . . 0.0 110.3 -179.889 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 12.0 mttp . . . . . 0 N--CA 1.492 1.674 0 CA-C-O 121.337 0.589 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 18.7 m -156.68 -101.56 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -0.906 . . . . 0.0 110.249 -179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.478 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 12.0 t-20 175.5 34.85 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.594 ' O ' ' N ' ' A' ' 6' ' ' THR . 1.7 m -169.48 105.17 0.36 Allowed 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 -178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -34.98 -25.99 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 CA-C-O 120.908 0.385 . . . . 0.0 110.985 -179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.594 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.0 t -74.0 -40.21 63.09 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 120.946 -1.096 . . . . 0.0 109.479 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' N ' ' O ' ' A' ' 4' ' ' THR . 21.2 t -74.42 -59.77 2.58 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.209 -0.932 . . . . 0.0 109.387 179.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.605 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -49.89 -46.78 52.09 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.586 -0.846 . . . . 0.0 108.969 179.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.508 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 6.8 m -57.31 -43.65 83.47 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.165 -0.959 . . . . 0.0 109.184 178.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.443 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -64.24 -25.38 68.04 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.53 -0.868 . . . . 0.0 110.399 -179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -89.11 -43.01 11.37 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.205 -1.776 . . . . 0.0 106.205 178.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.605 HD23 ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -61.38 -30.38 70.5 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.88 177.021 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.608 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -68.22 -37.8 81.23 Favored 'General case' 0 N--CA 1.488 1.439 0 CA-C-O 121.755 0.788 . . . . 0.0 109.279 179.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -58.56 -41.33 85.42 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.651 -0.656 . . . . 0.0 109.526 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.569 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -79.92 -22.05 43.19 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 178.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.608 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -60.3 -36.71 78.5 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.559 -0.857 . . . . 0.0 109.164 179.493 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.521 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 78.0 t -90.49 -33.36 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.462 -0.774 . . . . 0.0 109.952 179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.7 m170 -80.89 -36.85 30.69 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.277 -0.89 . . . . 0.0 110.338 -179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 22.8 t -90.13 -40.45 12.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.118 -0.989 . . . . 0.0 112.302 -178.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.48 ' O ' ' CE1' ' A' ' 23' ' ' PHE . 1.0 OUTLIER -91.2 -20.96 21.39 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.809 -1.182 . . . . 0.0 112.892 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.521 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 1.1 t-20 -88.74 -9.42 51.97 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.571 -1.331 . . . . 0.0 111.653 -178.48 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 10.4 t30 -57.31 -75.7 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.918 -1.113 . . . . 0.0 110.068 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.48 ' CE1' ' O ' ' A' ' 20' ' ' SER . 19.6 p90 -54.24 -28.09 39.03 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.092 -1.005 . . . . 0.0 109.024 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.26 -32.43 65.37 Favored Glycine 0 N--CA 1.488 2.108 0 N-CA-C 108.511 -1.836 . . . . 0.0 108.511 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.671 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -66.08 -16.55 64.03 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.419 -1.047 . . . . 0.0 109.448 179.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.842 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -89.29 -49.19 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.471 ' HA ' HD13 ' A' ' 27' ' ' LEU 0.255 3.7 mm? -61.66 -16.29 47.47 Favored 'General case' 0 C--N 1.296 -1.75 0 N-CA-C 107.773 -1.195 . . . . 0.0 107.773 176.345 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.485 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.9 m -67.91 -36.77 80.75 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 121.288 0.566 . . . . 0.0 110.378 179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.748 ' O ' HG22 ' A' ' 30' ' ' THR . 0.6 OUTLIER -86.53 -58.07 2.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.304 -0.873 . . . . 0.0 110.494 -179.725 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.748 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 81.59 -35.13 0.1 Allowed 'General case' 0 N--CA 1.504 2.234 0 CA-C-O 121.153 0.502 . . . . 0.0 110.855 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.418 ' ND2' HG23 ' A' ' 32' ' ' VAL . 0.1 OUTLIER -66.45 -7.06 17.08 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.164 -0.96 . . . . 0.0 109.68 179.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.418 HG23 ' ND2' ' A' ' 31' ' ' ASN . 3.6 t -124.31 -15.35 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 O-C-N 121.479 -0.763 . . . . 0.0 110.335 -179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -151.42 59.49 0.42 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.45 ' CB ' ' O ' ' A' ' 30' ' ' THR . 67.4 p -121.01 -86.59 0.65 Allowed 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.266 -1.137 . . . . 0.0 109.925 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.449 ' O ' ' OG1' ' A' ' 36' ' ' THR . 10.0 m-80 -149.45 129.55 13.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.285 -0.885 . . . . 0.0 110.151 179.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 35' ' ' ASN . 10.4 p 43.15 77.18 0.07 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.398 -0.814 . . . . 0.0 110.266 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.465 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 10.7 p90 . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 118.038 -0.982 . . . . 0.0 110.294 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.467 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 3.0 mtmp? . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.119 0.485 . . . . 0.0 109.994 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.467 ' SG ' ' O ' ' A' ' 1' ' ' LYS . 35.5 m -155.96 96.83 1.76 Allowed 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.44 -0.788 . . . . 0.0 109.432 -179.508 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.499 ' O ' ' OG1' ' A' ' 4' ' ' THR . 48.5 t30 -89.35 27.07 1.51 Allowed 'General case' 0 C--N 1.299 -1.606 0 O-C-N 121.388 -0.82 . . . . 0.0 109.119 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.846 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.2 p 63.01 -71.0 0.06 Allowed 'General case' 0 C--N 1.305 -1.341 0 O-C-N 121.971 -0.455 . . . . 0.0 109.935 -179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.521 ' N ' ' OG1' ' A' ' 4' ' ' THR . . . -46.12 -24.8 0.49 Allowed 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 118.299 -1.36 . . . . 0.0 107.918 178.032 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.497 HG22 ' N ' ' A' ' 7' ' ' CYS . 4.3 m -92.71 -76.79 0.46 Allowed 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.581 -0.699 . . . . 0.0 109.812 178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' N ' HG22 ' A' ' 6' ' ' THR . 10.9 m -60.16 -40.47 89.99 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 119.861 -0.736 . . . . 0.0 109.571 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.846 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -64.61 -48.72 73.86 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 118.886 -1.126 . . . . 0.0 108.919 179.14 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.55 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 1.3 m -51.15 -41.85 60.39 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 118.432 -1.307 . . . . 0.0 108.049 178.451 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ASN . 3.6 tp60 -65.52 -21.68 66.64 Favored 'General case' 0 C--N 1.305 -1.334 0 O-C-N 121.446 -0.784 . . . . 0.0 110.661 179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.588 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.08 -50.87 5.61 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 106.746 -1.576 . . . . 0.0 106.746 179.201 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.65 -42.18 98.54 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 114.743 -1.117 . . . . 0.0 109.762 177.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.55 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -68.77 -27.52 65.97 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.479 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.7 t30 -55.9 -41.11 74.01 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.588 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 2.2 m-85 -88.96 -16.92 30.58 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.548 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 7.6 tp -72.38 -41.42 66.35 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.22 -0.992 . . . . 0.0 109.354 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.489 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 92.4 t -86.17 -27.48 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 O-C-N 121.328 -0.858 . . . . 0.0 109.738 179.218 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.479 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 12.7 m170 -84.06 -49.49 8.86 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.278 -0.889 . . . . 0.0 109.928 179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 p -71.01 -24.54 62.39 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.302 -0.874 . . . . 0.0 110.645 -179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 11.3 t -90.5 -47.67 7.57 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.106 -0.996 . . . . 0.0 110.394 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 59.5 t-20 -56.88 -30.9 64.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.065 -1.022 . . . . 0.0 110.045 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.471 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -73.08 -43.03 62.39 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.255 -0.903 . . . . 0.0 109.91 179.575 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.563 ' CD1' ' C ' ' A' ' 23' ' ' PHE . 0.0 OUTLIER -52.17 -40.0 60.86 Favored 'General case' 0 C--N 1.303 -1.435 0 O-C-N 121.22 -0.925 . . . . 0.0 108.545 179.367 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.57 -38.56 96.58 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 108.599 -1.801 . . . . 0.0 108.599 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.571 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -63.53 -13.3 39.92 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.456 -1.026 . . . . 0.0 109.9 179.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.655 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.0 mm -91.31 -45.22 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' O ' ' N ' ' A' ' 31' ' ' ASN . 6.8 mp -47.29 -26.23 1.18 Allowed 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 176.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.501 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.6 m -61.11 -19.45 61.5 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.069 179.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.0 m -100.05 -31.78 11.26 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.424 -0.798 . . . . 0.0 110.736 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.534 ' O ' ' ND2' ' A' ' 31' ' ' ASN . 7.5 p -136.01 -16.55 1.68 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.832 -1.168 . . . . 0.0 111.192 -178.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.913 ' O ' HG23 ' A' ' 32' ' ' VAL . 0.6 OUTLIER 41.96 27.79 0.08 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.667 0.746 . . . . 0.0 109.189 -179.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.913 HG23 ' O ' ' A' ' 31' ' ' ASN . 1.4 t -174.31 -54.2 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.853 0 C-N-CA 119.968 -0.693 . . . . 0.0 109.869 179.658 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -37.15 -39.75 0.49 Allowed Glycine 0 N--CA 1.494 2.549 0 N-CA-C 110.376 -1.089 . . . . 0.0 110.376 -179.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -132.81 143.96 49.9 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.06 -1.259 . . . . 0.0 110.506 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.505 ' HB2' HD11 ' A' ' 27' ' ' LEU . 9.3 m120 47.63 74.89 0.15 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.255 -0.903 . . . . 0.0 110.326 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 36' ' ' THR . 13.3 t -120.67 63.3 0.86 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.427 ' CD1' ' C ' ' A' ' 37' ' ' TYR . 29.2 p90 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.212 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 121.226 0.536 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.533 ' H ' ' HB2' ' A' ' 8' ' ' ALA . 36.3 t -52.01 -73.25 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.246 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.45 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER 178.53 -34.8 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.642 ' HB ' HG22 ' A' ' 6' ' ' THR . 75.9 p -125.34 124.28 41.21 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.468 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -42.23 -22.49 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.494 -0.754 . . . . 0.0 109.86 179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.642 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.8 t -77.79 -29.3 50.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.314 -0.866 . . . . 0.0 109.884 179.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' N ' ' O ' ' A' ' 4' ' ' THR . 8.9 t -89.31 -63.69 1.25 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.189 -0.944 . . . . 0.0 109.634 179.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.533 ' HB2' ' H ' ' A' ' 2' ' ' CYS . . . -44.58 -51.49 8.94 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.355 -0.841 . . . . 0.0 108.995 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.468 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 99.0 m -57.65 -48.06 80.52 Favored 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.199 -0.938 . . . . 0.0 109.342 178.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.536 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.77 -17.41 64.53 Favored 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.243 -0.911 . . . . 0.0 110.63 179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.468 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 3.2 ttm180 -91.19 -43.24 9.97 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 178.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.477 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 3.9 mm? -66.2 -37.08 84.74 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.686 -1.143 . . . . 0.0 109.189 177.745 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.537 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.26 -29.54 66.35 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.541 -0.724 . . . . 0.0 109.192 178.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -60.78 -43.83 97.57 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 178.918 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.608 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.97 -23.56 31.0 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 178.859 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.537 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -58.71 -58.33 9.06 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.396 -0.815 . . . . 0.0 109.862 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.4 t -71.1 -32.53 48.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.373 -0.83 . . . . 0.0 110.299 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.564 ' O ' ' N ' ' A' ' 22' ' ' ASN . 5.8 m170 -81.47 -68.16 0.72 Allowed 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.19 -0.944 . . . . 0.0 110.288 -179.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.544 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 8.5 t -39.32 -40.17 0.75 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.004 -0.678 . . . . 0.0 111.214 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.511 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 1.2 t -65.77 -62.12 1.69 Allowed 'General case' 0 C--N 1.297 -1.707 0 O-C-N 120.951 -1.093 . . . . 0.0 109.969 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.783 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -92.47 22.9 4.28 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.329 -0.857 . . . . 0.0 110.543 179.938 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.564 ' N ' ' O ' ' A' ' 18' ' ' HIS . 11.2 t-20 -92.36 -63.82 1.19 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.041 -1.037 . . . . 0.0 111.049 -179.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.615 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 7.1 p90 -41.74 -33.77 0.54 Allowed 'General case' 0 N--CA 1.49 1.538 0 CA-C-O 121.871 0.844 . . . . 0.0 109.29 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.615 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.03 -26.64 23.55 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.624 -1.391 . . . . 0.0 109.624 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.783 ' HB2' ' O ' ' A' ' 21' ' ' ASN . . . -76.68 -21.06 55.9 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -1.163 . . . . 0.0 110.684 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.878 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.5 mm -90.95 -45.03 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 179.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 27' ' ' LEU . 11.6 mt -58.27 -19.8 37.28 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 176.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.431 ' O ' ' OG ' ' A' ' 29' ' ' SER . 4.2 m -78.37 -5.56 52.63 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.001 178.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.431 ' OG ' ' O ' ' A' ' 28' ' ' SER . 50.7 m -165.08 63.66 0.12 Allowed 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.278 -0.889 . . . . 0.0 109.797 -179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.585 HG23 ' N ' ' A' ' 31' ' ' ASN . 5.4 t -125.17 -44.88 1.87 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-O 121.582 0.706 . . . . 0.0 110.217 -179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.618 ' C ' HG23 ' A' ' 32' ' ' VAL . 1.7 t-20 168.66 -21.78 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.87 -0.519 . . . . 0.0 110.55 179.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.618 HG23 ' C ' ' A' ' 31' ' ' ASN . 2.8 t 70.68 13.38 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.191 -0.943 . . . . 0.0 110.155 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.447 ' N ' ' OD1' ' A' ' 31' ' ' ASN . . . -135.15 -107.8 0.94 Allowed Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.1 m -114.92 -26.92 7.57 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.275 -1.132 . . . . 0.0 110.065 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.437 ' O ' ' C ' ' A' ' 36' ' ' THR . 11.3 t30 55.36 -163.89 0.13 Allowed 'General case' 0 N--CA 1.488 1.452 0 O-C-N 121.351 -0.843 . . . . 0.0 110.697 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.437 ' C ' ' O ' ' A' ' 35' ' ' ASN . 17.7 p -37.79 98.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.708 -0.62 . . . . 0.0 110.947 -179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.405 ' N ' ' O ' ' A' ' 35' ' ' ASN . 10.2 p90 . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.087 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.209 0.528 . . . . 0.0 110.121 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 22.8 m -112.89 -116.56 0.32 Allowed 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.22 -0.925 . . . . 0.0 109.798 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' A' ' 4' ' ' THR . 11.6 t-20 -162.44 17.64 0.09 Allowed 'General case' 0 N--CA 1.487 1.391 0 O-C-N 121.145 -0.972 . . . . 0.0 110.147 179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.8 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 0.7 OUTLIER 72.88 -83.51 0.03 OUTLIER 'General case' 0 C--N 1.311 -1.106 0 O-C-N 120.946 -1.096 . . . . 0.0 109.911 -179.714 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.502 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -44.93 -22.05 0.08 Allowed 'General case' 0 C--N 1.296 -1.757 0 O-C-N 120.534 -1.354 . . . . 0.0 108.748 178.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.523 ' N ' ' O ' ' A' ' 4' ' ' THR . 0.6 OUTLIER -91.4 -75.29 0.48 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.328 -0.858 . . . . 0.0 110.941 179.401 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.464 ' HA ' ' HB2' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -63.19 -25.9 68.55 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.912 -1.117 . . . . 0.0 109.49 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.8 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -70.65 -56.99 5.19 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.741 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.417 ' CG2' ' O ' ' A' ' 5' ' ' ALA . 44.5 p -56.58 -28.27 59.87 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.386 -1.326 . . . . 0.0 107.902 178.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' HA ' ' A' ' 7' ' ' CYS . 4.5 mm100 -78.28 -22.15 48.68 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-O 121.553 0.692 . . . . 0.0 109.616 179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.07 -42.04 13.37 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 105.457 -2.053 . . . . 0.0 105.457 178.247 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.621 HD23 ' O ' ' A' ' 8' ' ' ALA . 3.7 mm? -57.3 -45.05 84.52 Favored 'General case' 0 C--N 1.292 -1.93 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.55 176.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.496 ' O ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.9 -22.28 65.09 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -63.88 -45.31 89.97 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.589 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 9.0 m-85 -65.94 -23.41 66.6 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.496 ' HB2' ' O ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -55.35 -40.27 71.06 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 178.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.9 t -85.65 -44.97 17.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 120.109 -0.637 . . . . 0.0 109.955 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.489 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 21.9 m-70 -66.84 -50.03 63.85 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.217 -0.927 . . . . 0.0 109.693 179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.534 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.2 t -55.51 -53.34 57.56 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.287 -0.883 . . . . 0.0 109.711 179.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 t -61.02 -18.83 59.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.374 -0.828 . . . . 0.0 109.9 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 53.1 t30 -74.19 -49.91 21.46 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.219 -0.925 . . . . 0.0 110.036 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.435 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 5.1 t-20 -65.22 -53.09 49.8 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.438 -0.789 . . . . 0.0 109.784 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.494 ' CZ ' ' CD2' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -52.4 -35.46 51.78 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 121.395 -0.815 . . . . 0.0 109.002 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -79.2 -17.94 75.44 Favored Glycine 0 N--CA 1.488 2.13 0 N-CA-C 109.1 -1.6 . . . . 0.0 109.1 179.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.697 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -74.32 -19.51 60.44 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.38 -1.071 . . . . 0.0 109.902 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.825 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -91.36 -51.71 11.28 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.521 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 179.387 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' CD2' ' CZ ' ' A' ' 23' ' ' PHE . 3.8 mp -51.61 -23.82 4.74 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 176.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.3 m -59.41 -13.11 7.3 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.539 179.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.77 ' O ' HG22 ' A' ' 30' ' ' THR . 0.3 OUTLIER -91.69 -59.66 2.07 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.127 -0.983 . . . . 0.0 109.444 179.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.77 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 64.58 -48.51 0.32 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.457 -0.777 . . . . 0.0 111.216 179.423 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.528 ' N ' ' O ' ' A' ' 29' ' ' SER . 0.2 OUTLIER -83.09 12.15 5.44 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.146 -0.971 . . . . 0.0 110.035 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.7 p -70.84 -3.1 3.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.212 -0.93 . . . . 0.0 110.316 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.88 51.54 0.11 Allowed Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.4 t -158.11 -83.21 0.05 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.34 -1.094 . . . . 0.0 110.47 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.461 ' O ' ' O ' ' A' ' 36' ' ' THR . 71.3 m-80 -84.45 161.65 20.23 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.4 -0.812 . . . . 0.0 110.414 -179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.461 ' O ' ' O ' ' A' ' 35' ' ' ASN . 27.1 p 44.56 96.08 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.36 -0.838 . . . . 0.0 110.231 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.151 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.232 0.539 . . . . 0.0 110.302 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 1.0 OUTLIER -69.91 -85.48 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.274 -0.891 . . . . 0.0 110.591 179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.557 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 13.8 t-20 170.08 -26.75 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 -179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.611 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.0 OUTLIER -132.78 124.91 28.97 Favored 'General case' 0 N--CA 1.484 1.26 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.517 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -40.41 -24.72 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.152 -0.619 . . . . 0.0 109.651 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.611 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.7 t -67.36 -39.13 85.68 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.242 -0.912 . . . . 0.0 108.782 178.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.524 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.6 t -79.25 -47.61 15.63 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.91 -49.25 77.37 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.517 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 18.7 m -56.14 -39.61 72.53 Favored 'General case' 0 N--CA 1.484 1.263 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 178.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -69.1 -19.25 64.05 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.65 0.738 . . . . 0.0 109.418 178.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 1.7 mmm180 -87.61 -51.28 5.98 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 105.264 -2.124 . . . . 0.0 105.264 177.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.918 ' O ' HD13 ' A' ' 16' ' ' LEU . 10.6 mt -56.08 -29.94 61.29 Favored 'General case' 0 C--N 1.293 -1.888 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 175.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.648 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.78 -26.1 62.29 Favored 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 30.6 t-20 -58.94 -46.76 87.19 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.096 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.546 ' O ' ' CB ' ' A' ' 19' ' ' SER . 2.1 m-85 -76.94 -21.18 55.19 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 179.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.918 HD13 ' O ' ' A' ' 12' ' ' LEU . 4.9 mp -67.33 -67.58 0.44 Allowed 'General case' 0 C--N 1.302 -1.5 0 C-N-CA 119.202 -0.999 . . . . 0.0 109.176 179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 71.8 t -58.63 -26.31 30.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.353 -0.842 . . . . 0.0 110.445 179.659 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.489 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 31.3 m-70 -88.56 -52.8 4.97 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.187 -0.946 . . . . 0.0 111.298 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.0 p -68.81 -32.62 72.46 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.281 -0.887 . . . . 0.0 110.145 -179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.512 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 59.7 m -74.47 -40.26 61.99 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.997 -1.065 . . . . 0.0 109.1 179.091 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 0.8 OUTLIER -45.04 -36.51 3.55 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.111 179.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.492 ' O ' HG12 ' A' ' 26' ' ' ILE . 8.8 t30 -62.52 -62.05 2.01 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.621 -0.832 . . . . 0.0 109.995 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.04 -26.39 10.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.468 -0.77 . . . . 0.0 109.515 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.03 -37.99 36.55 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 108.985 -1.646 . . . . 0.0 108.985 179.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.689 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -67.11 -9.92 44.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.266 -1.138 . . . . 0.0 109.918 179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.799 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.2 mm -91.25 -44.96 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 N-CA-C 107.512 -1.292 . . . . 0.0 107.512 178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.908 ' O ' HG22 ' A' ' 30' ' ' THR . 11.8 mt -49.24 -27.23 3.54 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.456 -1.313 . . . . 0.0 107.456 176.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.5 m -58.39 -34.6 70.91 Favored 'General case' 0 N--CA 1.485 1.304 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.825 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.89 11.82 13.6 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.576 -0.703 . . . . 0.0 110.102 -179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.908 HG22 ' O ' ' A' ' 27' ' ' LEU . 2.5 t -45.32 -54.98 6.43 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-O 122.084 0.945 . . . . 0.0 109.632 179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.917 ' O ' HG22 ' A' ' 32' ' ' VAL . 14.1 p30 -148.97 13.68 0.89 Allowed 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 179.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.917 HG22 ' O ' ' A' ' 31' ' ' ASN . 0.9 OUTLIER 56.97 39.1 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 CA-C-O 121.771 0.796 . . . . 0.0 110.371 -179.753 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' N ' ' OD1' ' A' ' 31' ' ' ASN . . . -62.01 -80.57 0.11 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 110.901 -0.879 . . . . 0.0 110.901 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 3.4 t -82.51 171.23 14.33 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.193 -1.181 . . . . 0.0 111.774 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' A' ' 37' ' ' TYR . 10.7 t30 61.9 157.61 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.625 -0.672 . . . . 0.0 110.609 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.591 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 4.0 t -61.1 79.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.433 -0.792 . . . . 0.0 109.201 179.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.598 ' OXT' ' CD2' ' A' ' 37' ' ' TYR . 3.1 p90 . . . . . 0 N--CA 1.485 1.303 0 CA-C-O 117.822 -1.085 . . . . 0.0 110.982 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.174 0.511 . . . . 0.0 110.076 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 52.6 t -179.49 -76.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.277 -0.889 . . . . 0.0 110.243 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.507 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.2 t-20 177.03 -33.57 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.703 0 CA-C-O 121.917 0.865 . . . . 0.0 108.799 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.548 ' CB ' HG22 ' A' ' 6' ' ' THR . 14.7 p -132.37 122.94 25.83 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 109.022 -0.733 . . . . 0.0 109.022 179.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.499 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -39.88 -25.94 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.679 -0.638 . . . . 0.0 109.555 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.548 HG22 ' CB ' ' A' ' 4' ' ' THR . 6.1 t -64.37 -42.45 96.17 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' CG2' ' A' ' 6' ' ' THR . 5.3 t -84.12 -42.99 15.46 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 178.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.461 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -60.82 -53.38 58.06 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 178.65 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.499 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 85.3 m -55.55 -38.59 69.5 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.875 -1.13 . . . . 0.0 108.147 178.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -71.13 -21.26 62.22 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.846 0.832 . . . . 0.0 109.394 178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.7 mmt180 -87.01 -43.03 12.65 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' O ' HD23 ' A' ' 16' ' ' LEU . 2.3 mm? -57.57 -39.57 77.03 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.482 -1.236 . . . . 0.0 108.791 176.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.82 -28.34 67.48 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -60.63 -43.32 97.65 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.507 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -75.81 -17.85 59.7 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.045 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.566 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.7 OUTLIER -67.11 -38.66 86.01 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.591 -0.844 . . . . 0.0 108.978 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.495 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 46.7 t -86.41 -29.2 5.96 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.467 0 O-C-N 121.592 -0.692 . . . . 0.0 109.335 179.271 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -85.1 -51.56 6.56 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.369 -0.832 . . . . 0.0 110.535 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.462 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.3 p -68.81 -39.92 79.82 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.324 -0.86 . . . . 0.0 110.812 -179.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.587 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 7.8 t -69.1 -52.62 26.43 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.192 -0.943 . . . . 0.0 110.037 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.495 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 24.7 t-20 -45.08 -31.25 1.31 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.638 -0.664 . . . . 0.0 110.917 -179.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.428 ' OD1' ' C ' ' A' ' 22' ' ' ASN . 0.1 OUTLIER -43.78 -45.39 7.24 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.033 -1.042 . . . . 0.0 110.244 -179.614 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.587 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.1 OUTLIER -57.77 -14.44 5.82 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.449 -0.782 . . . . 0.0 110.159 -179.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.57 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.51 -28.33 17.1 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.701 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -65.74 -25.22 67.19 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.41 -1.053 . . . . 0.0 109.752 179.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.836 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.7 mm -90.76 -46.69 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 179.309 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 23' ' ' PHE . 4.2 mm? -61.44 -17.45 54.44 Favored 'General case' 0 C--N 1.295 -1.792 0 N-CA-C 107.299 -1.371 . . . . 0.0 107.299 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.453 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.4 m -69.46 -0.38 6.44 Favored 'General case' 0 N--CA 1.487 1.4 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.15 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.79 5.04 32.92 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.686 -1.259 . . . . 0.0 110.705 -179.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.653 HG23 ' N ' ' A' ' 31' ' ' ASN . 4.6 t -58.11 -47.88 81.89 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-O 122.227 1.013 . . . . 0.0 109.045 178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.653 ' N ' HG23 ' A' ' 30' ' ' THR . 0.8 OUTLIER 176.3 27.33 0.0 OUTLIER 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 115.441 -0.799 . . . . 0.0 108.955 179.206 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.516 ' O ' ' N ' ' A' ' 34' ' ' SER . 32.6 m -123.13 43.83 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.378 -0.826 . . . . 0.0 109.042 179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -38.24 -28.35 0.05 OUTLIER Glycine 0 N--CA 1.493 2.46 0 N-CA-C 109.922 -1.271 . . . . 0.0 109.922 -179.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.516 ' N ' ' O ' ' A' ' 32' ' ' VAL . 1.9 t 67.47 22.08 9.42 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.234 -1.157 . . . . 0.0 109.658 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.445 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.7 t30 -88.1 166.03 14.71 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.518 -0.739 . . . . 0.0 109.945 179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' ASN . 6.2 m 54.69 105.46 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.357 -0.839 . . . . 0.0 110.042 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.6 p90 . . . . . 0 N--CA 1.49 1.535 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.22 -179.831 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.462 ' HB3' ' HB1' ' A' ' 8' ' ' ALA . 11.8 mttt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.296 0.57 . . . . 0.0 110.287 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.445 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 41.9 t -45.66 -78.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.388 -0.82 . . . . 0.0 110.05 179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.445 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.0 t-20 178.52 -35.16 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.539 ' CG2' HG22 ' A' ' 6' ' ' THR . 3.0 m -121.51 121.53 37.71 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.514 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.53 -24.21 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.264 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.576 HG23 ' N ' ' A' ' 7' ' ' CYS . 14.9 t -74.61 -40.77 61.35 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.211 -0.931 . . . . 0.0 109.372 179.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.576 ' N ' HG23 ' A' ' 6' ' ' THR . 9.4 t -77.31 -57.79 3.63 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.423 -0.798 . . . . 0.0 109.829 179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -49.83 -46.27 51.0 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.385 -0.822 . . . . 0.0 109.45 179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.514 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 22.1 m -64.77 -44.16 90.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.276 -0.89 . . . . 0.0 109.818 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.516 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -78.15 -10.95 59.87 Favored 'General case' 0 N--CA 1.486 1.368 0 O-C-N 121.362 -0.836 . . . . 0.0 111.122 -179.328 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.6 OUTLIER -91.38 -51.72 5.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 106.859 -1.534 . . . . 0.0 106.859 178.984 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.476 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 7.5 mt -58.51 -45.22 89.24 Favored 'General case' 0 C--N 1.29 -1.995 0 CA-C-N 114.869 -1.059 . . . . 0.0 108.869 177.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.455 ' HA ' ' CB ' ' A' ' 16' ' ' LEU . . . -64.52 -27.4 68.94 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 178.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.493 ' HB3' ' O ' ' A' ' 11' ' ' ARG . 20.1 t-20 -53.36 -46.92 69.77 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.564 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -90.68 -20.14 22.82 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.535 -0.728 . . . . 0.0 109.07 179.801 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 12' ' ' LEU . 0.1 OUTLIER -70.68 -40.4 72.95 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.507 -0.877 . . . . 0.0 109.629 -179.905 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.497 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 33.1 t -84.64 -29.48 6.88 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.495 0 O-C-N 121.303 -0.873 . . . . 0.0 109.619 179.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.49 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 9.9 m170 -85.86 -47.52 9.61 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.465 -0.772 . . . . 0.0 110.924 -179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.558 ' HA ' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -78.22 -22.95 47.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.244 -0.91 . . . . 0.0 111.692 -178.555 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 4.2 p -91.12 -40.43 11.6 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.592 -1.318 . . . . 0.0 111.423 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 1.071 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 8.2 t30 -90.69 -42.47 10.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.044 -1.035 . . . . 0.0 111.669 -178.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.578 ' HA ' HG12 ' A' ' 26' ' ' ILE . 0.5 OUTLIER -85.39 -45.41 11.91 Favored 'General case' 0 C--N 1.296 -1.738 0 O-C-N 120.813 -1.179 . . . . 0.0 111.513 -178.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.558 ' HB3' ' HA ' ' A' ' 19' ' ' SER . 4.2 t80 -77.52 -40.12 43.78 Favored 'General case' 0 C--N 1.295 -1.774 0 O-C-N 121.108 -0.995 . . . . 0.0 111.339 -178.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -90.86 -40.88 5.48 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.614 -1.279 . . . . 0.0 111.625 -178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 1.071 ' HB3' ' O ' ' A' ' 21' ' ' ASN . . . -75.55 -24.5 56.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.613 -1.521 . . . . 0.0 111.668 -178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.667 ' N ' HD13 ' A' ' 26' ' ' ILE . 3.7 mm -92.28 -42.53 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 120.63 -1.294 . . . . 0.0 108.594 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.558 ' HB2' ' O ' ' A' ' 23' ' ' PHE 0.262 3.0 mm? -50.42 -27.39 6.33 Favored 'General case' 0 C--N 1.298 -1.645 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 175.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.461 ' O ' ' OG ' ' A' ' 29' ' ' SER . 50.2 m -78.05 -22.54 48.97 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.623 179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.524 ' N ' ' O ' ' A' ' 26' ' ' ILE . 74.6 m -167.62 66.72 0.08 Allowed 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.343 -0.848 . . . . 0.0 109.672 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.434 HG21 ' HB2' ' A' ' 34' ' ' SER . 4.8 t -59.44 -30.0 68.18 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 108.012 -1.106 . . . . 0.0 108.012 179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.935 ' O ' HG13 ' A' ' 32' ' ' VAL . 0.0 OUTLIER -164.54 -30.19 0.03 OUTLIER 'General case' 0 C--N 1.295 -1.801 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.757 178.808 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.935 HG13 ' O ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER 178.57 39.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.111 0 O-C-N 121.342 -0.849 . . . . 0.0 109.855 178.583 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' O ' ' HB3' ' A' ' 34' ' ' SER . . . 102.21 -44.99 1.42 Allowed Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.457 ' HB3' ' O ' ' A' ' 33' ' ' GLY . 5.6 t 56.34 45.13 23.45 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.112 -1.228 . . . . 0.0 110.203 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.458 ' O ' ' OG1' ' A' ' 36' ' ' THR . 25.3 t30 -84.89 138.26 32.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.318 -0.863 . . . . 0.0 110.061 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 35' ' ' ASN . 46.5 p 44.53 92.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.168 -0.957 . . . . 0.0 110.067 -179.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.431 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 117.955 -1.022 . . . . 0.0 110.29 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 16.5 tttm . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.211 0.529 . . . . 0.0 110.34 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 83.1 m -115.06 -116.2 0.33 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.221 -0.924 . . . . 0.0 109.494 179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.54 ' O ' ' CB ' ' A' ' 4' ' ' THR . 8.5 t30 -148.8 10.85 0.83 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.279 -0.888 . . . . 0.0 109.607 179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.908 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 1.5 m 77.57 -82.06 0.03 OUTLIER 'General case' 0 C--N 1.309 -1.159 0 O-C-N 121.471 -0.768 . . . . 0.0 110.468 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.542 ' O ' ' CG2' ' A' ' 9' ' ' THR . . . -43.86 -21.92 0.05 OUTLIER 'General case' 0 C--N 1.295 -1.796 0 O-C-N 120.818 -1.176 . . . . 0.0 109.542 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.7 p -91.47 -85.84 0.23 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.134 -0.979 . . . . 0.0 110.595 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.469 ' N ' ' OG1' ' A' ' 6' ' ' THR . 2.1 m -55.82 -30.45 61.42 Favored 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.538 -0.726 . . . . 0.0 109.625 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.908 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -74.63 -58.9 2.99 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.114 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.816 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 1.5 t -50.67 -27.15 6.42 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 118.347 -1.341 . . . . 0.0 109.623 -179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.75 -35.71 72.78 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.603 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 14.4 ttp180 -88.21 -39.73 14.25 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 178.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.1 mm? -64.24 -25.99 68.31 Favored 'General case' 0 C--N 1.29 -2.0 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.077 176.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.816 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -67.56 -43.18 81.28 Favored 'General case' 0 N--CA 1.49 1.572 0 CA-C-O 121.725 0.774 . . . . 0.0 109.719 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.554 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 40.7 t30 -56.32 -42.66 78.01 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-O 121.561 0.696 . . . . 0.0 109.639 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -86.65 -12.98 46.9 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.636 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -69.5 -40.4 77.02 Favored 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.284 -0.966 . . . . 0.0 108.967 179.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.469 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 46.3 t -80.73 -33.06 13.23 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.297 -0.877 . . . . 0.0 109.256 179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.8 m170 -81.97 -48.78 11.05 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.462 -0.774 . . . . 0.0 110.495 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.6 t -70.75 -50.4 36.41 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.212 -0.93 . . . . 0.0 110.794 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.546 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 3.4 t -61.39 -38.67 87.9 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.201 -0.937 . . . . 0.0 110.329 -179.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.469 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 26.2 t30 -64.06 -10.4 21.9 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.298 -0.876 . . . . 0.0 109.95 179.748 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.447 ' O ' HG12 ' A' ' 26' ' ' ILE . 1.9 t-20 -47.6 -77.1 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.259 -0.901 . . . . 0.0 110.209 179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.64 ' O ' HD23 ' A' ' 27' ' ' LEU . 18.4 p90 -56.24 -24.4 42.23 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.394 -0.816 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.94 -38.06 64.77 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.66 -1.376 . . . . 0.0 109.66 -179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.715 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -71.37 -21.45 62.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.244 -1.151 . . . . 0.0 110.422 -179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.877 ' O ' HG23 ' A' ' 30' ' ' THR . 2.4 mm -91.92 -42.71 13.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 N-CA-C 107.918 -1.141 . . . . 0.0 107.918 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD23 ' O ' ' A' ' 23' ' ' PHE . 0.6 OUTLIER -48.14 -27.06 2.15 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.279 -1.378 . . . . 0.0 107.279 176.553 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.4 m -62.03 -12.66 19.98 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.05 178.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.1 m -152.99 54.41 0.77 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.234 -0.916 . . . . 0.0 110.632 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.877 HG23 ' O ' ' A' ' 26' ' ' ILE . 72.7 p -133.23 -43.81 0.85 Allowed 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.255 -0.903 . . . . 0.0 110.651 -179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.43 -25.94 0.75 Allowed 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.338 -0.851 . . . . 0.0 109.465 179.737 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -79.65 -33.9 15.38 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 CA-C-O 121.449 0.643 . . . . 0.0 109.504 179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 30' ' ' THR . . . 133.36 102.08 0.78 Allowed Glycine 0 N--CA 1.489 2.171 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 11.3 t -116.19 31.77 6.52 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.259 -1.142 . . . . 0.0 109.988 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 29.2 t30 -103.4 55.58 0.75 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.288 -0.883 . . . . 0.0 110.264 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.548 ' C ' ' CD2' ' A' ' 37' ' ' TYR . 41.0 p -108.84 71.77 0.79 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.285 -0.884 . . . . 0.0 110.487 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.548 ' CD2' ' C ' ' A' ' 36' ' ' THR . 39.2 p90 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.539 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.8 mtmm . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.17 0.51 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 26.9 t -98.53 -108.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.179 -0.95 . . . . 0.0 110.099 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.536 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.5 t30 169.6 -21.29 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.044 -1.035 . . . . 0.0 109.695 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 6' ' ' THR . 0.2 OUTLIER -113.21 108.57 17.46 Favored 'General case' 0 C--N 1.307 -1.279 0 O-C-N 121.249 -0.907 . . . . 0.0 109.813 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.482 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -38.73 -28.98 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 CA-C-O 121.51 0.672 . . . . 0.0 109.689 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.762 HG22 HG22 ' A' ' 4' ' ' THR . 9.4 t -67.01 -44.91 79.1 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.629 ' N ' HG23 ' A' ' 6' ' ' THR . 0.2 OUTLIER -72.25 -39.08 68.71 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 178.097 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.482 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -62.45 -53.51 53.73 Favored 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.677 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 18.2 m -57.39 -33.81 68.22 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.518 ' NE2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.8 -27.73 66.13 Favored 'General case' 0 N--CA 1.484 1.267 0 O-C-N 121.47 -0.769 . . . . 0.0 109.803 179.273 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -87.56 -47.12 8.96 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 105.554 -2.017 . . . . 0.0 105.554 177.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 4.0 mm? -58.99 -22.57 60.76 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-N 114.626 -1.17 . . . . 0.0 108.146 176.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.814 ' HA ' HD12 ' A' ' 16' ' ' LEU . . . -73.53 -37.71 65.53 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-O 121.885 0.85 . . . . 0.0 109.287 179.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -57.82 -42.5 84.43 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.582 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -81.64 -17.22 48.88 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.804 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 13' ' ' ALA . 5.6 mt -66.04 -61.04 2.26 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 118.85 -1.14 . . . . 0.0 108.508 178.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 89.4 t -56.34 -41.98 72.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 C-N-CA 119.369 -0.932 . . . . 0.0 109.773 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 27.5 m170 -72.84 -56.67 4.88 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.39 -0.819 . . . . 0.0 110.528 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.571 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.4 t -65.6 -50.52 64.78 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.291 -0.88 . . . . 0.0 110.618 -179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 70.7 m -44.31 -44.61 8.22 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.097 -1.002 . . . . 0.0 109.428 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -51.01 -41.74 59.97 Favored 'General case' 0 C--N 1.302 -1.457 0 C-N-CA 119.454 -0.899 . . . . 0.0 109.001 179.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 1.3 t30 -73.27 -54.66 7.84 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.439 -0.788 . . . . 0.0 109.097 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.613 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -51.78 -30.35 22.59 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.423 -0.954 . . . . 0.0 108.423 178.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.407 ' HA2' ' HB2' ' A' ' 27' ' ' LEU . . . -77.01 -28.17 59.07 Favored Glycine 0 N--CA 1.486 2.029 0 N-CA-C 108.309 -1.916 . . . . 0.0 108.309 178.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.712 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -65.0 -18.41 65.27 Favored 'General case' 0 N--CA 1.485 1.321 0 O-C-N 121.442 -1.034 . . . . 0.0 108.998 179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.824 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.0 mm -91.57 -39.57 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.683 ' O ' HG22 ' A' ' 30' ' ' THR . 3.6 mp -63.38 -13.49 40.04 Favored 'General case' 0 C--N 1.297 -1.688 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 176.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.474 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.8 m -75.44 -1.93 26.36 Favored 'General case' 0 N--CA 1.482 1.17 0 O-C-N 121.793 -0.567 . . . . 0.0 109.916 179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 2.3 m -143.61 8.49 1.54 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.211 -0.93 . . . . 0.0 110.878 -179.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.689 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -55.74 -78.41 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.21 -0.931 . . . . 0.0 109.653 179.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.689 ' H ' HG23 ' A' ' 30' ' ' THR . 0.1 OUTLIER -136.7 8.95 3.08 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.446 -0.784 . . . . 0.0 109.102 179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.515 ' HB ' ' O ' ' A' ' 31' ' ' ASN . 10.8 t 65.82 5.93 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.799 0 O-C-N 121.522 -0.736 . . . . 0.0 110.745 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 165.61 -92.98 0.11 Allowed Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.445 ' O ' ' O ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -170.9 40.35 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -1.096 . . . . 0.0 110.093 -179.926 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.445 ' O ' ' O ' ' A' ' 34' ' ' SER . 54.4 t30 57.3 111.06 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.358 -0.839 . . . . 0.0 110.248 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 35.1 m -62.66 93.29 0.05 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.209 -0.932 . . . . 0.0 110.192 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 3.0 p90 . . . . . 0 N--CA 1.49 1.574 0 CA-C-O 118.074 -0.965 . . . . 0.0 110.142 -179.837 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.432 ' HB3' ' NZ ' ' A' ' 1' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.167 0.508 . . . . 0.0 110.239 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.497 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 3.3 m -93.61 -65.24 1.01 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.24 -0.913 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 9.6 t30 175.5 -32.54 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 107.686 -1.227 . . . . 0.0 107.686 -179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.53 ' O ' ' N ' ' A' ' 7' ' ' CYS . 3.1 m -99.23 115.13 28.41 Favored 'General case' 0 C--N 1.305 -1.331 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 179.024 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.57 -27.19 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 CA-C-O 121.337 0.589 . . . . 0.0 109.816 179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.555 ' CG2' ' N ' ' A' ' 7' ' ' CYS . 5.2 t -67.72 -45.08 76.09 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.219 -0.925 . . . . 0.0 108.619 178.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.555 ' N ' ' CG2' ' A' ' 6' ' ' THR . 38.9 t -76.53 -49.97 15.11 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.318 -0.864 . . . . 0.0 108.733 178.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.479 ' O ' HD13 ' A' ' 12' ' ' LEU . . . -51.62 -51.07 58.6 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.478 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.7 m -59.71 -45.97 90.51 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 121.426 -0.796 . . . . 0.0 108.952 178.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.587 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -69.63 -13.17 62.17 Favored 'General case' 0 C--N 1.309 -1.189 0 O-C-N 121.155 -0.966 . . . . 0.0 109.96 179.525 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.526 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.3 OUTLIER -91.1 -52.85 4.63 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.94 -1.874 . . . . 0.0 105.94 178.172 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 8' ' ' ALA . 4.1 mp -52.0 -42.43 63.0 Favored 'General case' 0 C--N 1.294 -1.842 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 176.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.542 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -63.61 -31.17 72.25 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 178.19 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.526 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 3.7 t-20 -53.26 -52.67 58.25 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.45 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 2.6 m-85 -60.92 -22.03 63.97 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.25 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.553 ' O ' ' CB ' ' A' ' 20' ' ' SER . 1.6 tp -75.77 -38.66 58.15 Favored 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 121.696 0.76 . . . . 0.0 109.149 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.59 ' HA ' ' HB3' ' A' ' 21' ' ' ASN . 17.7 t -88.32 -36.35 9.11 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.504 0 O-C-N 121.235 -0.915 . . . . 0.0 109.366 179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 5.4 m-70 -74.65 -52.85 10.57 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.13 -0.981 . . . . 0.0 111.153 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.93 -31.37 15.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.245 -0.909 . . . . 0.0 112.273 -178.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.566 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 0.2 OUTLIER -91.05 -27.21 18.76 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.746 -1.221 . . . . 0.0 112.648 -178.043 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.59 ' HB3' ' HA ' ' A' ' 17' ' ' VAL . 0.0 OUTLIER -77.75 -12.72 60.0 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.337 -1.477 . . . . 0.0 110.492 -179.462 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -42.31 -66.41 0.36 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 120.923 -1.11 . . . . 0.0 110.365 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.566 ' CE2' ' O ' ' A' ' 20' ' ' SER . 6.7 p90 -60.32 -31.35 70.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.265 -0.897 . . . . 0.0 110.363 -179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.555 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -77.93 -20.59 73.03 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.707 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -78.75 -19.97 51.04 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.295 -1.121 . . . . 0.0 109.937 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.807 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.0 mm -90.49 -47.1 14.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 178.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.4 mm? -51.42 -25.46 6.3 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 175.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 8.8 m -76.52 5.22 7.68 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.458 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.487 ' N ' ' O ' ' A' ' 26' ' ' ILE . 1.3 m -178.29 52.09 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.059 -1.025 . . . . 0.0 110.438 -179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.521 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 0.3 OUTLIER -93.83 -73.31 0.57 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.175 -0.953 . . . . 0.0 108.615 178.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.708 ' O ' HG12 ' A' ' 32' ' ' VAL . 30.2 p30 -122.92 -4.61 8.56 Favored 'General case' 0 C--N 1.295 -1.784 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.742 HG13 ' HB3' ' A' ' 35' ' ' ASN . 0.3 OUTLIER 55.15 36.57 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.716 -0.615 . . . . 0.0 109.872 -179.791 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.544 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . -21.26 -50.72 0.01 OUTLIER Glycine 0 N--CA 1.502 3.055 0 N-CA-C 111.037 -0.825 . . . . 0.0 111.037 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.503 ' N ' ' O ' ' A' ' 32' ' ' VAL . 0.7 OUTLIER -67.05 79.09 0.13 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -1.195 . . . . 0.0 109.67 179.359 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.742 ' HB3' HG13 ' A' ' 32' ' ' VAL . 9.0 p30 -153.52 176.06 12.48 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.219 -0.926 . . . . 0.0 110.454 -179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.411 ' O ' ' C ' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -49.7 103.73 0.05 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.313 -0.867 . . . . 0.0 109.946 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 1.1 p90 . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.31 -179.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.463 ' O ' ' HE3' ' A' ' 1' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.461 0.648 . . . . 0.0 110.355 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.541 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -132.09 -74.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.336 -0.853 . . . . 0.0 109.375 179.501 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.635 ' O ' HG23 ' A' ' 4' ' ' THR . 6.4 t30 162.25 -25.47 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.872 -1.159 . . . . 0.0 107.872 179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.643 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.1 OUTLIER -166.95 139.88 3.6 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 179.762 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.456 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -41.61 -23.32 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.703 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 178.624 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.643 HG22 ' HB ' ' A' ' 4' ' ' THR . 4.5 t -72.32 -39.88 67.87 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 4' ' ' THR . 43.6 t -70.03 -40.26 75.29 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.75 -48.41 63.8 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 178.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.621 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 5.5 m -57.71 -32.63 67.57 Favored 'General case' 0 C--N 1.306 -1.299 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 177.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.456 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 4.9 tt0 -69.26 -25.19 64.14 Favored 'General case' 0 C--N 1.308 -1.216 0 CA-C-O 121.74 0.781 . . . . 0.0 109.687 179.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.483 ' O ' ' N ' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -88.64 -53.55 4.58 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 105.354 -2.091 . . . . 0.0 105.354 178.288 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 0.2 OUTLIER -50.3 -37.83 38.37 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 107.464 -1.31 . . . . 0.0 107.464 175.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.621 ' HB2' ' O ' ' A' ' 9' ' ' THR . . . -63.72 -31.45 72.62 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 178.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.486 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.2 OUTLIER -50.98 -44.55 60.81 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.551 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.2 m-85 -91.59 -26.79 18.55 Favored 'General case' 0 N--CA 1.489 1.487 0 N-CA-C 108.555 -0.905 . . . . 0.0 108.555 178.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -70.75 -43.87 67.93 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 118.619 -1.232 . . . . 0.0 108.693 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 21' ' ' ASN . 23.9 t -73.51 -31.64 33.56 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.585 0 O-C-N 121.185 -0.947 . . . . 0.0 109.256 178.702 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.486 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -85.18 -36.56 20.94 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.416 -0.803 . . . . 0.0 110.693 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.551 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 9.5 t -89.4 -20.36 24.05 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.182 -0.949 . . . . 0.0 111.416 -178.749 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 20.2 m -89.75 -46.43 8.6 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.758 -1.214 . . . . 0.0 110.641 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.512 ' HB2' ' O ' ' A' ' 17' ' ' VAL . 2.9 m-80 -56.06 -16.32 4.85 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.964 -1.085 . . . . 0.0 109.762 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.512 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.6 OUTLIER -37.07 -46.62 0.68 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.582 -0.699 . . . . 0.0 110.795 179.808 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.493 ' O ' ' N ' ' A' ' 26' ' ' ILE . 15.8 m-85 -63.79 -45.92 87.53 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.0 110.14 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.442 ' O ' ' OG ' ' A' ' 28' ' ' SER . . . -47.63 -26.88 4.13 Favored Glycine 0 N--CA 1.485 1.963 0 N-CA-C 107.915 -2.074 . . . . 0.0 107.915 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -84.13 -24.08 30.41 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.716 -0.873 . . . . 0.0 110.153 179.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.537 ' N ' HD13 ' A' ' 26' ' ' ILE . 5.6 mm -91.83 -53.83 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 178.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.406 ' N ' ' CD2' ' A' ' 27' ' ' LEU . 4.0 mm? -49.78 -30.24 9.23 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 176.298 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.538 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -47.53 -35.77 9.43 Favored 'General case' 0 N--CA 1.485 1.276 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 178.131 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.616 ' C ' HG22 ' A' ' 30' ' ' THR . 39.3 m -112.58 -67.99 0.96 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.748 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.8 OUTLIER 159.9 -57.77 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.89 0.852 . . . . 0.0 109.859 178.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.748 ' H ' HG23 ' A' ' 30' ' ' THR . 10.3 p30 -153.61 -1.48 0.21 Allowed 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.902 -0.499 . . . . 0.0 111.243 -179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.599 HG13 ' N ' ' A' ' 33' ' ' GLY . 7.8 p -175.21 -45.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 120.707 -1.245 . . . . 0.0 110.586 179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.599 ' N ' HG13 ' A' ' 32' ' ' VAL . . . 106.3 -56.94 0.49 Allowed Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.416 -1.473 . . . . 0.0 109.416 -179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 79.2 p -144.96 -95.88 0.1 Allowed 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.266 -1.138 . . . . 0.0 110.39 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -124.23 179.14 5.01 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.079 -1.013 . . . . 0.0 110.099 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.729 HG23 ' O ' ' A' ' 36' ' ' THR . 13.1 t -44.85 105.81 0.06 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.099 -1.001 . . . . 0.0 110.087 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.452 ' CD1' ' C ' ' A' ' 37' ' ' TYR . 18.3 p90 . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.305 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.148 0.499 . . . . 0.0 109.971 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 7.6 t -44.79 -68.43 0.2 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.263 -0.898 . . . . 0.0 110.431 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.4 t-20 171.1 -26.47 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.481 -0.762 . . . . 0.0 108.968 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.75 ' CG2' HG22 ' A' ' 6' ' ' THR . 2.5 m -136.97 120.38 16.98 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.661 -0.649 . . . . 0.0 109.348 179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.449 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.69 -25.64 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.483 -0.761 . . . . 0.0 109.768 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.75 HG22 ' CG2' ' A' ' 4' ' ' THR . 8.9 t -73.76 -40.27 63.6 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.326 -0.859 . . . . 0.0 109.519 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.606 ' N ' HG23 ' A' ' 6' ' ' THR . 7.0 t -72.31 -54.42 9.57 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.608 -0.682 . . . . 0.0 109.91 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -57.22 -36.6 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 109.357 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 40.9 m -73.43 -42.98 61.35 Favored 'General case' 0 N--CA 1.488 1.445 0 O-C-N 121.404 -0.81 . . . . 0.0 109.381 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.561 ' HG2' ' HA ' ' A' ' 7' ' ' CYS . 3.9 pt20 -83.28 -5.26 59.07 Favored 'General case' 0 C--N 1.309 -1.19 0 O-C-N 121.362 -0.836 . . . . 0.0 110.472 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.527 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 0.9 OUTLIER -90.43 -51.71 5.28 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 178.87 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.481 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -63.47 -49.33 74.06 Favored 'General case' 0 C--N 1.288 -2.09 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.035 176.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.498 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.15 -21.79 65.34 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.56 ' OD1' ' CD2' ' A' ' 18' ' ' HIS . 4.1 t-20 -55.98 -59.59 4.69 Favored 'General case' 0 C--N 1.307 -1.273 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 178.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.6 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.9 OUTLIER -57.26 -22.95 45.04 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.658 -1.217 . . . . 0.0 108.036 178.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.498 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -74.72 -41.24 60.52 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.64 -0.824 . . . . 0.0 109.28 179.117 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.554 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 6.9 t -90.33 -42.81 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.212 -0.93 . . . . 0.0 110.033 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.596 ' HA ' ' HB2' ' A' ' 22' ' ' ASN . 6.2 m-70 -67.67 -36.94 81.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.427 -0.796 . . . . 0.0 110.843 -179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -90.17 -42.64 10.94 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.348 -178.286 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 16' ' ' LEU . 0.5 OUTLIER -91.71 -42.5 10.11 Favored 'General case' 0 C--N 1.296 -1.737 0 O-C-N 121.02 -1.05 . . . . 0.0 112.9 -177.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.554 ' HB2' ' HA ' ' A' ' 17' ' ' VAL . 0.9 OUTLIER -92.37 -36.18 13.3 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.973 -1.079 . . . . 0.0 112.561 -177.747 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.596 ' HB2' ' HA ' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -61.27 -46.64 89.52 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 120.987 -1.071 . . . . 0.0 111.39 -178.584 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.486 ' CD2' ' O ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -53.21 -30.29 36.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.042 -1.036 . . . . 0.0 109.482 -179.831 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.445 ' O ' ' CB ' ' A' ' 28' ' ' SER . . . -82.31 -32.09 29.31 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 108.948 -1.661 . . . . 0.0 108.948 179.395 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.764 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -62.62 -16.07 54.89 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.459 -1.024 . . . . 0.0 109.821 179.656 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.898 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.3 mm -91.68 -44.19 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 179.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.452 ' O ' ' CG2' ' A' ' 30' ' ' THR 0.25 0.9 OUTLIER -71.85 -7.75 50.22 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 107.278 -1.378 . . . . 0.0 107.278 175.901 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.528 ' HB2' ' HA ' ' A' ' 25' ' ' ALA . 3.5 m -90.74 -16.46 28.39 Favored 'General case' 0 N--CA 1.482 1.171 0 CA-C-O 121.465 0.65 . . . . 0.0 110.262 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 30' ' ' THR . 0.1 OUTLIER -66.84 -32.83 74.36 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.194 -0.941 . . . . 0.0 111.398 -178.433 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.695 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -43.26 -71.08 0.09 Allowed 'General case' 0 C--N 1.292 -1.907 0 CA-C-O 121.916 0.865 . . . . 0.0 109.069 179.024 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.695 ' H ' HG23 ' A' ' 30' ' ' THR . 26.1 t30 -139.09 8.04 2.47 Favored 'General case' 0 C--N 1.297 -1.681 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.59 HG12 ' O ' ' A' ' 31' ' ' ASN . 0.4 OUTLIER 73.99 0.05 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 O-C-N 121.401 -0.812 . . . . 0.0 110.259 -179.839 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.14 -56.79 4.59 Favored Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' CG1' ' A' ' 32' ' ' VAL . 0.1 OUTLIER -159.28 171.57 19.61 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.181 -1.188 . . . . 0.0 110.31 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 46.09 76.65 0.09 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.127 -0.983 . . . . 0.0 109.923 -179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.456 ' O ' ' OXT' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -124.76 67.32 1.1 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.303 -0.873 . . . . 0.0 110.394 -179.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.456 ' OXT' ' O ' ' A' ' 36' ' ' THR . 51.9 p90 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 117.894 -1.05 . . . . 0.0 110.091 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.9 mptt . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.378 0.608 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 40.0 t -177.07 -95.8 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.314 -0.866 . . . . 0.0 109.991 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.581 ' O ' HG23 ' A' ' 4' ' ' THR . 17.7 t-20 173.46 24.21 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -179.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.64 ' HB ' HG22 ' A' ' 6' ' ' THR . 0.0 OUTLIER 167.02 113.43 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.355 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -178.912 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -42.6 -16.59 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.316 -0.865 . . . . 0.0 111.365 179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.64 HG22 ' HB ' ' A' ' 4' ' ' THR . 3.3 t -87.33 -30.41 20.85 Favored 'General case' 0 N--CA 1.487 1.425 0 O-C-N 121.027 -1.046 . . . . 0.0 108.285 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' N ' ' O ' ' A' ' 4' ' ' THR . 11.8 p -85.12 -38.13 19.43 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.267 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -64.69 -46.92 80.34 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 178.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 3.3 p -58.79 -42.11 88.29 Favored 'General case' 0 C--N 1.305 -1.359 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 6' ' ' THR . 11.5 mm-40 -75.57 -13.93 60.37 Favored 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 121.507 0.67 . . . . 0.0 109.804 179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.439 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 12.4 tpp180 -90.12 -43.09 10.7 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -62.27 -44.54 96.3 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-N 114.557 -1.201 . . . . 0.0 108.767 177.183 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.57 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.7 -25.6 67.39 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 178.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.521 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 5.5 t30 -58.79 -44.35 90.7 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 179.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -83.89 -19.59 34.51 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.215 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.3 tp -71.87 -63.9 1.04 Allowed 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.218 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.557 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 64.3 t -61.44 -25.91 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.045 . . . . 0.0 109.697 179.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.521 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 16.0 m-70 -86.66 -53.03 5.18 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.251 -0.906 . . . . 0.0 110.648 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.53 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 0.5 OUTLIER -79.56 -25.12 41.69 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.268 -0.895 . . . . 0.0 111.278 -178.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.547 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.6 t -90.48 -42.94 10.57 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.02 -1.05 . . . . 0.0 110.847 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.692 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 6.9 t-20 -66.35 -54.5 23.79 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.065 -1.022 . . . . 0.0 110.257 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.602 ' HA ' HG12 ' A' ' 26' ' ' ILE . 5.1 m120 -56.4 -31.13 63.57 Favored 'General case' 0 C--N 1.298 -1.659 0 O-C-N 121.022 -1.049 . . . . 0.0 110.195 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.744 ' O ' HD12 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -75.11 -51.79 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.164 -0.96 . . . . 0.0 110.908 -179.349 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.98 -33.94 8.61 Favored Glycine 0 N--CA 1.493 2.484 0 C-N-CA 119.981 -1.104 . . . . 0.0 110.929 -178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.692 ' HB3' ' O ' ' A' ' 21' ' ' ASN . . . -70.44 -28.97 65.44 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.012 -1.287 . . . . 0.0 111.416 -178.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.602 HG12 ' HA ' ' A' ' 22' ' ' ASN . 5.8 mm -92.1 -41.47 12.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 O-C-N 120.659 -1.275 . . . . 0.0 108.351 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.744 HD12 ' O ' ' A' ' 23' ' ' PHE . 11.2 mt -51.45 -25.23 6.03 Favored 'General case' 0 C--N 1.296 -1.729 0 N-CA-C 107.132 -1.432 . . . . 0.0 107.132 176.107 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.3 m -68.03 -8.95 42.02 Favored 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.998 179.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.46 ' HB3' ' HA ' ' A' ' 32' ' ' VAL . 24.6 m -158.47 59.28 0.45 Allowed 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.456 -0.777 . . . . 0.0 109.606 -179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.595 ' CG2' ' N ' ' A' ' 31' ' ' ASN . 4.8 t -56.0 -42.01 75.76 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.007 0.908 . . . . 0.0 108.961 179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.595 ' N ' ' CG2' ' A' ' 30' ' ' THR . 5.1 p-10 -95.33 9.89 38.21 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.928 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.826 ' O ' HG12 ' A' ' 32' ' ' VAL . 9.8 t 60.47 50.32 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.228 0 CA-C-O 122.32 1.057 . . . . 0.0 109.382 -179.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . -118.19 -100.47 2.02 Favored Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.387 -1.485 . . . . 0.0 109.387 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.436 ' C ' ' O ' ' A' ' 33' ' ' GLY . 0.3 OUTLIER 41.34 27.16 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -1.143 . . . . 0.0 110.35 179.88 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.452 ' N ' ' O ' ' A' ' 33' ' ' GLY . 18.4 t-20 -134.94 53.68 1.98 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.411 -0.806 . . . . 0.0 109.874 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -133.48 94.85 3.38 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.44 -0.787 . . . . 0.0 110.084 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.3 p90 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 118.047 -0.978 . . . . 0.0 109.98 179.974 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.425 ' O ' ' C ' ' A' ' 2' ' ' CYS . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 121.281 0.562 . . . . 0.0 110.209 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' C ' ' O ' ' A' ' 1' ' ' LYS . 44.4 t -40.42 -70.6 0.1 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.493 -0.754 . . . . 0.0 110.469 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 6.9 t30 178.8 -37.07 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.714 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.7 OUTLIER -126.89 127.17 44.5 Favored 'General case' 0 C--N 1.299 -1.605 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 179.002 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.525 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.93 -21.29 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.42 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.714 HG22 ' OG1' ' A' ' 4' ' ' THR . 7.2 t -75.6 -37.74 59.59 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.093 -1.005 . . . . 0.0 109.644 179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.535 ' H ' HG23 ' A' ' 4' ' ' THR . 36.0 t -83.15 -62.52 1.57 Allowed 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.204 -0.935 . . . . 0.0 109.747 179.429 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -43.22 -63.33 0.83 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.124 179.463 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.535 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 91.9 m -48.5 -42.05 31.74 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.793 179.209 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.541 ' HB2' ' O ' ' A' ' 6' ' ' THR . 6.2 tt0 -61.07 -31.6 71.26 Favored 'General case' 0 N--CA 1.485 1.318 0 O-C-N 121.044 -1.035 . . . . 0.0 110.949 -179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' CG ' ' CZ ' ' A' ' 15' ' ' PHE . 17.3 ttp85 -92.2 -44.98 8.48 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.833 -1.167 . . . . 0.0 107.853 179.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 5.5 mp -61.83 -45.77 92.39 Favored 'General case' 0 C--N 1.287 -2.117 0 CA-C-N 114.938 -1.028 . . . . 0.0 109.538 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.535 ' CB ' ' O ' ' A' ' 9' ' ' THR . . . -66.74 -28.67 68.6 Favored 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 178.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -54.04 -42.61 69.4 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 178.842 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.32 -18.31 28.76 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 178.657 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.53 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 6.7 tp -71.76 -36.57 70.44 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.498 -0.881 . . . . 0.0 109.444 179.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.543 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 34.2 t -87.83 -35.52 8.34 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 O-C-N 121.166 -0.959 . . . . 0.0 109.347 178.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.473 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 6.9 m-70 -79.29 -48.54 13.94 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.412 -0.805 . . . . 0.0 111.211 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.6 OUTLIER -90.13 -29.68 18.14 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.917 -1.114 . . . . 0.0 112.287 -178.3 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.528 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -91.05 -27.16 18.79 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.695 -1.253 . . . . 0.0 111.971 -178.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.543 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 5.9 t-20 -76.42 -34.01 58.8 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 120.656 -1.277 . . . . 0.0 110.804 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.5 ' O ' HG12 ' A' ' 26' ' ' ILE . 55.1 t30 -81.13 -44.66 17.58 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.198 -0.939 . . . . 0.0 110.966 -179.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.557 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -57.74 -36.3 71.87 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.326 -0.859 . . . . 0.0 110.156 -179.614 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.468 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -78.28 -27.86 56.95 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.738 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -68.23 -22.26 64.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.281 -1.129 . . . . 0.0 111.259 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.795 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.1 mm -91.79 -43.65 14.09 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 120.832 -1.167 . . . . 0.0 108.655 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD13 ' O ' ' A' ' 23' ' ' PHE . 6.2 mp -49.08 -26.4 2.66 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 176.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.462 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.0 m -62.28 -20.79 64.64 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-O 121.607 0.718 . . . . 0.0 109.645 178.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.697 ' O ' HG22 ' A' ' 30' ' ' THR . 22.3 m -148.03 -72.61 0.2 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.717 -0.615 . . . . 0.0 109.792 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.697 HG22 ' O ' ' A' ' 29' ' ' SER . 0.6 OUTLIER 91.51 -39.26 0.02 OUTLIER 'General case' 0 N--CA 1.505 2.295 0 CA-C-O 121.49 0.662 . . . . 0.0 109.696 -179.813 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.537 ' O ' HG12 ' A' ' 32' ' ' VAL . 52.2 p-10 -156.21 12.14 0.29 Allowed 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.569 -0.707 . . . . 0.0 110.387 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.624 HG13 ' O ' ' A' ' 32' ' ' VAL . 0.4 OUTLIER 53.91 18.52 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.121 -0.987 . . . . 0.0 110.074 179.977 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -132.85 3.42 4.94 Favored Glycine 0 N--CA 1.493 2.438 0 N-CA-C 109.881 -1.287 . . . . 0.0 109.881 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 2.4 t -79.31 116.3 19.47 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.176 -1.191 . . . . 0.0 110.178 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.716 ' O ' HG23 ' A' ' 36' ' ' THR . 1.4 t-20 -85.38 54.85 3.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.25 -0.906 . . . . 0.0 110.368 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.716 HG23 ' O ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER 178.41 48.15 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.313 -0.867 . . . . 0.0 110.237 179.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.7 p90 . . . . . 0 C--N 1.302 -1.467 0 CA-C-O 117.879 -1.057 . . . . 0.0 110.424 -179.937 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.5 mtmm . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.296 0.57 . . . . 0.0 110.03 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 52.1 t -64.42 -80.69 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.241 -0.912 . . . . 0.0 110.442 -179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 11.1 t-20 179.0 -35.01 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.651 ' HB ' HG22 ' A' ' 6' ' ' THR . 59.4 p -119.02 120.95 38.74 Favored 'General case' 0 C--N 1.301 -1.538 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.441 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -40.97 -25.18 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.953 -0.699 . . . . 0.0 109.544 179.506 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.651 HG22 ' HB ' ' A' ' 4' ' ' THR . 9.0 t -74.67 -35.73 62.79 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.412 -0.805 . . . . 0.0 109.91 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.526 ' N ' ' O ' ' A' ' 4' ' ' THR . 7.6 t -80.07 -56.64 4.1 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.435 -0.791 . . . . 0.0 109.823 179.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -47.17 -62.86 1.22 Allowed 'General case' 0 C--N 1.302 -1.46 0 O-C-N 121.119 -0.988 . . . . 0.0 108.768 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.69 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 58.4 p -52.93 -36.83 60.25 Favored 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.15 -1.02 . . . . 0.0 108.483 178.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER -60.35 -32.69 71.51 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.78 -1.2 . . . . 0.0 110.232 179.473 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.506 ' O ' ' HB3' ' A' ' 14' ' ' ASN . 0.0 OUTLIER -91.76 -46.35 7.94 Favored 'General case' 0 N--CA 1.488 1.463 0 CA-C-O 122.703 1.24 . . . . 0.0 107.805 179.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.466 ' O ' ' HB2' ' A' ' 16' ' ' LEU . 4.9 mp -61.9 -57.47 11.64 Favored 'General case' 0 C--N 1.286 -2.165 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.048 178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.69 ' HB3' ' O ' ' A' ' 9' ' ' THR . . . -59.17 -26.45 64.78 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.217 -1.031 . . . . 0.0 108.217 178.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.591 ' O ' ' CG ' ' A' ' 18' ' ' HIS . 16.7 t-20 -47.98 -50.19 28.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 107.702 -1.221 . . . . 0.0 107.702 178.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 19' ' ' SER . 0.7 OUTLIER -92.96 -25.28 18.08 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 179.073 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.548 ' O ' ' CB ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -70.0 -37.96 75.83 Favored 'General case' 0 N--CA 1.493 1.721 0 C-N-CA 119.397 -0.921 . . . . 0.0 109.892 -179.331 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.462 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 11.1 t -87.69 -30.69 5.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.58 0 O-C-N 121.199 -0.938 . . . . 0.0 109.155 179.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.591 ' CG ' ' O ' ' A' ' 14' ' ' ASN . 11.6 m170 -81.4 -47.12 13.64 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.6 -0.688 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -87.09 -31.81 20.27 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.128 -0.983 . . . . 0.0 111.7 -178.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.613 ' O ' ' CE1' ' A' ' 23' ' ' PHE . 0.1 OUTLIER -91.89 -40.08 11.37 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.088 . . . . 0.0 111.908 -179.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.462 ' HB2' ' HA ' ' A' ' 17' ' ' VAL . 5.7 t-20 -83.69 -10.98 57.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.887 -1.133 . . . . 0.0 111.657 -178.578 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.542 ' O ' HG12 ' A' ' 26' ' ' ILE . 3.1 t30 -55.57 -55.97 25.74 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.924 -1.11 . . . . 0.0 110.926 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.613 ' CE1' ' O ' ' A' ' 20' ' ' SER . 0.3 OUTLIER -48.8 -21.5 0.64 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.052 -1.03 . . . . 0.0 110.346 -179.61 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.558 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -90.36 -47.61 3.74 Favored Glycine 0 N--CA 1.494 2.502 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 -179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.476 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -64.93 -20.82 66.66 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.27 -1.135 . . . . 0.0 111.128 -179.154 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.542 HG12 ' O ' ' A' ' 22' ' ' ASN . 15.9 mm -92.56 -35.18 6.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.466 0 O-C-N 120.878 -1.139 . . . . 0.0 108.349 179.14 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HG ' ' O ' ' A' ' 23' ' ' PHE . 10.7 mt -50.19 -27.49 5.98 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 176.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.1 m -56.26 -23.17 34.61 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-O 121.875 0.845 . . . . 0.0 108.818 177.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.743 ' O ' HG22 ' A' ' 30' ' ' THR . 10.3 m -144.19 -76.77 0.23 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.809 -0.557 . . . . 0.0 109.531 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.743 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 67.31 -53.32 0.48 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.575 -0.703 . . . . 0.0 110.22 179.758 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.743 ' OD1' HG22 ' A' ' 30' ' ' THR . 13.0 p-10 -113.55 0.14 14.57 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.108 -0.995 . . . . 0.0 109.466 179.366 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.588 HG13 ' O ' ' A' ' 32' ' ' VAL . 0.5 OUTLIER 59.8 15.17 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.451 -0.78 . . . . 0.0 110.345 179.634 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.437 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 114.79 113.79 2.99 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.817 -1.313 . . . . 0.0 109.817 179.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.437 ' C ' ' O ' ' A' ' 33' ' ' GLY . 70.9 m -41.75 127.84 3.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.36 -1.082 . . . . 0.0 110.223 179.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -139.51 102.7 4.53 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.246 -0.909 . . . . 0.0 110.376 -179.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.67 93.84 4.74 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.269 -0.894 . . . . 0.0 109.846 179.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.509 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 6.9 p90 . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 118.027 -0.987 . . . . 0.0 110.347 -179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.129 0.49 . . . . 0.0 110.304 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.616 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 2.5 m -110.29 -108.43 0.34 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.144 -0.973 . . . . 0.0 110.105 179.669 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.616 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 6.5 t30 149.17 -28.18 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 -179.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.701 ' HB ' HG22 ' A' ' 6' ' ' THR . 80.5 p -84.38 107.5 16.68 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.664 179.062 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.661 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -35.56 -30.99 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 CA-C-O 121.35 0.595 . . . . 0.0 109.843 179.656 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.701 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.6 t -57.41 -45.93 84.03 Favored 'General case' 0 N--CA 1.489 1.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 178.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.584 ' N ' HG23 ' A' ' 6' ' ' THR . 37.9 t -89.14 -45.12 9.83 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 178.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.661 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -55.12 -54.3 44.92 Favored 'General case' 0 C--N 1.303 -1.454 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.541 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 28.2 m -57.81 -42.19 83.75 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.152 -0.967 . . . . 0.0 109.025 178.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.447 ' CG ' ' O ' ' A' ' 6' ' ' THR . 21.7 mm-40 -71.74 -18.22 62.15 Favored 'General case' 0 N--CA 1.485 1.32 0 O-C-N 121.176 -0.952 . . . . 0.0 109.977 179.501 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.573 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -90.49 -49.86 6.27 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 178.757 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.545 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.2 OUTLIER -56.7 -46.43 81.24 Favored 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.839 -1.073 . . . . 0.0 108.614 176.81 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -60.35 -32.22 71.06 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.485 0.66 . . . . 0.0 109.268 179.128 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.569 ' O ' ' CD2' ' A' ' 18' ' ' HIS . 4.8 t-20 -57.88 -44.54 86.74 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.582 -0.699 . . . . 0.0 109.298 179.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.573 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 1.0 OUTLIER -87.82 -22.78 24.29 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.538 -0.912 . . . . 0.0 108.538 179.485 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -72.94 -53.15 12.03 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.251 -0.979 . . . . 0.0 109.19 179.724 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.508 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 48.3 t -66.49 -29.53 46.84 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 121.111 -0.993 . . . . 0.0 109.348 178.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.569 ' CD2' ' O ' ' A' ' 14' ' ' ASN . 10.7 m-70 -86.34 -57.82 2.86 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.351 -0.843 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.8 t -69.41 -26.66 64.74 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.466 -0.772 . . . . 0.0 111.664 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.585 ' O ' ' CD2' ' A' ' 23' ' ' PHE . 2.7 t -90.66 -46.49 8.23 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.032 -1.042 . . . . 0.0 110.892 -179.493 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.508 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 39.6 t30 -64.75 -9.96 24.09 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.067 -1.021 . . . . 0.0 110.93 -179.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.423 ' O ' ' N ' ' A' ' 25' ' ' ALA . 1.3 m-20 -51.95 -65.69 0.51 Allowed 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.064 -1.022 . . . . 0.0 111.428 -179.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.585 ' CD2' ' O ' ' A' ' 20' ' ' SER . 7.9 p90 -47.33 -28.78 2.15 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.048 -1.032 . . . . 0.0 109.467 -179.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.508 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -70.77 -38.18 66.4 Favored Glycine 0 N--CA 1.49 2.25 0 N-CA-C 108.704 -1.759 . . . . 0.0 108.704 179.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.698 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -66.7 -9.99 42.08 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.434 -1.039 . . . . 0.0 109.785 179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.817 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.1 mm -90.83 -48.08 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 179.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.9 mm? -49.11 -24.71 1.74 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 176.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.2 m -66.81 -3.72 7.48 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.95 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.537 ' C ' HG23 ' A' ' 30' ' ' THR . 26.4 m -116.61 33.04 5.78 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.995 -1.066 . . . . 0.0 110.939 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.537 HG23 ' C ' ' A' ' 29' ' ' SER . 67.4 p -151.5 -87.5 0.07 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.103 -0.998 . . . . 0.0 110.193 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.748 ' O ' HG12 ' A' ' 32' ' ' VAL . 26.1 t30 -87.47 -47.98 8.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.2 -0.937 . . . . 0.0 109.938 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.748 HG12 ' O ' ' A' ' 31' ' ' ASN . 6.8 p 41.84 25.81 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.667 -0.646 . . . . 0.0 110.445 -179.747 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.494 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . 31.86 52.27 0.35 Allowed Glycine 0 N--CA 1.498 2.783 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.561 ' HB3' HG13 ' A' ' 32' ' ' VAL . 78.6 p -113.34 100.34 8.47 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.114 -1.227 . . . . 0.0 110.657 -179.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.623 ' C ' HG22 ' A' ' 36' ' ' THR . 2.7 p-10 179.15 48.19 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.135 179.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.623 HG22 ' C ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER 167.47 51.51 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.569 -0.707 . . . . 0.0 109.877 179.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 6.4 p90 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 118.089 -0.957 . . . . 0.0 110.062 -179.936 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.3 0.571 . . . . 0.0 110.071 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.541 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.8 OUTLIER -58.08 -89.74 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.214 -0.929 . . . . 0.0 110.617 -179.724 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.541 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.6 t-20 159.27 -28.39 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 106.958 -1.497 . . . . 0.0 106.958 -179.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.634 ' HB ' HG22 ' A' ' 6' ' ' THR . 1.4 p -94.92 112.76 24.45 Favored 'General case' 0 C--N 1.304 -1.406 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.433 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -38.48 -25.34 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.823 -0.548 . . . . 0.0 110.682 -179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.634 HG22 ' HB ' ' A' ' 4' ' ' THR . 1.5 t -72.61 -33.96 67.05 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.873 -1.142 . . . . 0.0 109.221 179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.551 ' N ' ' O ' ' A' ' 4' ' ' THR . 36.8 t -89.72 -38.07 14.11 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.271 -0.893 . . . . 0.0 108.807 178.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.543 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -60.35 -56.5 20.7 Favored 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 178.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.428 HG23 ' O ' ' A' ' 5' ' ' ALA . 81.5 p -60.14 -38.32 82.75 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.363 -0.935 . . . . 0.0 108.948 178.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.503 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.1 OUTLIER -73.58 -19.83 60.77 Favored 'General case' 0 N--CA 1.486 1.342 0 O-C-N 121.225 -0.922 . . . . 0.0 110.201 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.449 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.0 tpm_? -90.71 -43.06 10.36 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 106.157 -1.794 . . . . 0.0 106.157 178.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.592 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 0.4 OUTLIER -60.58 -41.14 94.05 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-N 114.813 -1.085 . . . . 0.0 108.493 177.135 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.593 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.44 -28.35 68.53 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -56.23 -47.9 77.55 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.592 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 7.0 m-85 -68.31 -21.35 64.77 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 178.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.593 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -64.47 -54.15 37.02 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.336 -0.852 . . . . 0.0 109.727 179.61 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 17.6 t -72.77 -33.25 43.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.288 -0.883 . . . . 0.0 110.02 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 50.4 m-70 -79.5 -58.47 3.19 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.138 -0.976 . . . . 0.0 110.293 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.569 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 6.7 t -52.99 -22.95 6.32 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.001 -1.062 . . . . 0.0 110.077 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.599 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 31.5 t -81.68 -31.93 31.98 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.269 -0.894 . . . . 0.0 110.021 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 34.9 t-20 -91.2 -22.35 20.68 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.3 -0.875 . . . . 0.0 109.992 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.557 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.7 OUTLIER -57.86 -46.51 84.72 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.242 -0.911 . . . . 0.0 110.762 -179.534 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.599 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.4 OUTLIER -47.87 -23.06 0.66 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.379 -0.826 . . . . 0.0 110.107 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.582 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -78.92 -45.47 9.11 Favored Glycine 0 N--CA 1.487 2.058 0 N-CA-C 108.494 -1.842 . . . . 0.0 108.494 179.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.704 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -61.83 -11.43 12.55 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.411 -1.052 . . . . 0.0 110.215 179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.805 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -91.94 -40.62 12.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 179.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 27' ' ' LEU . 12.1 mt -47.21 -28.43 1.88 Allowed 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 176.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.487 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.9 m -59.29 -17.22 27.05 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.257 178.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.94 18.95 8.29 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.447 -0.783 . . . . 0.0 110.551 -179.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.509 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 32.3 p -138.93 -76.04 0.37 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.239 -0.913 . . . . 0.0 110.271 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.685 ' O ' HG12 ' A' ' 32' ' ' VAL . 17.1 t-20 -53.41 -23.81 10.8 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.362 -0.836 . . . . 0.0 109.702 179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.685 HG12 ' O ' ' A' ' 31' ' ' ASN . 11.3 p 42.22 28.81 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 CA-C-O 121.652 0.739 . . . . 0.0 110.08 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.412 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 77.38 14.8 82.13 Favored Glycine 0 N--CA 1.493 2.44 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.412 ' C ' ' O ' ' A' ' 33' ' ' GLY . 54.2 p 42.35 -149.52 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.221 -1.164 . . . . 0.0 110.191 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -163.97 95.4 0.78 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.368 -0.833 . . . . 0.0 110.055 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.02 70.07 6.32 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.935 . . . . 0.0 110.218 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.549 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 35.5 p90 . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 118.045 -0.978 . . . . 0.0 110.25 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.1 0.476 . . . . 0.0 110.385 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.6 OUTLIER -107.31 -91.6 0.42 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.124 -0.985 . . . . 0.0 110.377 179.859 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.549 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.2 t-20 159.98 -27.22 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.583 ' OG1' HG22 ' A' ' 6' ' ' THR . 2.6 t -103.82 115.99 31.47 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-O 121.688 0.756 . . . . 0.0 109.972 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.874 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . . . -39.73 -25.94 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.555 0 O-C-N 121.615 -0.678 . . . . 0.0 109.911 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.583 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.0 t -64.47 -39.8 94.49 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.553 ' N ' ' O ' ' A' ' 4' ' ' THR . 37.2 t -89.72 -32.73 16.87 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.874 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -66.31 -49.38 67.24 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.443 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 51.0 m -59.71 -39.22 83.9 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 177.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.475 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.9 OUTLIER -75.03 -20.01 59.78 Favored 'General case' 0 N--CA 1.484 1.252 0 O-C-N 121.501 -0.749 . . . . 0.0 109.519 178.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.456 ' N ' ' O ' ' A' ' 7' ' ' CYS . 1.4 mmt85 -84.84 -41.93 15.58 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 105.366 -2.087 . . . . 0.0 105.366 177.945 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -59.04 -30.42 68.03 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 114.198 -1.365 . . . . 0.0 107.973 176.488 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.594 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -67.64 -35.24 78.53 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 122.003 0.906 . . . . 0.0 108.618 178.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -58.28 -45.64 87.55 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.587 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.1 m-85 -70.54 -19.94 62.85 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 178.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.594 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 1.0 OUTLIER -57.67 -32.32 67.2 Favored 'General case' 0 C--N 1.306 -1.297 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 178.6 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 3.1 t -89.6 -46.2 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 C-N-CA 120.206 -0.598 . . . . 0.0 109.684 179.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' ASN . 5.3 m-70 -69.7 -47.52 62.87 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.177 -0.952 . . . . 0.0 109.824 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 3.7 t -64.25 -56.14 16.67 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.239 -0.913 . . . . 0.0 109.112 179.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.487 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 82.1 p -46.71 -35.97 6.66 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.228 -0.92 . . . . 0.0 109.083 179.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.478 ' HB3' ' O ' ' A' ' 18' ' ' HIS . 0.1 OUTLIER -50.32 -26.19 4.57 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 179.047 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.814 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 28.9 m-20 -47.96 -25.08 1.23 Allowed 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 119.204 -0.998 . . . . 0.0 108.504 178.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' O ' ' N ' ' A' ' 26' ' ' ILE . 3.3 m-85 -56.82 -50.51 72.16 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -51.02 -31.13 24.82 Favored Glycine 0 N--CA 1.483 1.828 0 N-CA-C 107.284 -2.326 . . . . 0.0 107.284 178.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.814 ' HB3' ' O ' ' A' ' 22' ' ' ASN . . . -71.11 -24.16 62.24 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.729 -0.865 . . . . 0.0 109.598 178.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.681 ' N ' HD13 ' A' ' 26' ' ' ILE . 3.7 mm -91.8 -44.78 14.37 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.462 ' HG ' ' HB ' ' A' ' 36' ' ' THR . 7.4 mp -45.92 -28.64 1.17 Allowed 'General case' 0 C--N 1.302 -1.462 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 176.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.8 m -51.11 -52.52 42.91 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-O 121.584 0.707 . . . . 0.0 109.681 178.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.751 ' O ' HG22 ' A' ' 30' ' ' THR . 0.4 OUTLIER -79.5 -46.97 16.41 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.422 -0.799 . . . . 0.0 110.159 179.857 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.751 HG22 ' O ' ' A' ' 29' ' ' SER . 0.5 OUTLIER 77.17 -15.13 0.77 Allowed 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.718 -0.614 . . . . 0.0 110.707 179.889 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.509 ' C ' ' ND2' ' A' ' 31' ' ' ASN . 0.2 OUTLIER -54.41 -14.86 1.36 Allowed 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.39 -0.819 . . . . 0.0 109.36 179.484 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 9.9 p -49.57 -17.48 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.153 -0.967 . . . . 0.0 109.905 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.416 ' N ' ' C ' ' A' ' 31' ' ' ASN . . . 154.66 39.71 0.02 OUTLIER Glycine 0 N--CA 1.492 2.378 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 47.14 37.49 5.48 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.301 -1.117 . . . . 0.0 109.92 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.418 ' O ' ' OG1' ' A' ' 36' ' ' THR . 0.3 OUTLIER -133.25 -168.52 2.1 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.337 -0.852 . . . . 0.0 110.021 179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.462 ' HB ' ' HG ' ' A' ' 27' ' ' LEU . 20.8 p 45.27 74.41 0.13 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.329 -0.857 . . . . 0.0 110.007 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.422 ' CD1' ' N ' ' A' ' 37' ' ' TYR . 1.7 p90 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.0 -1.0 . . . . 0.0 110.221 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.7 mtmm . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.314 0.578 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.509 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 13.2 m -133.8 -106.4 0.24 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.264 -0.898 . . . . 0.0 110.066 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.542 ' O ' ' CB ' ' A' ' 4' ' ' THR . 7.4 t-20 -137.96 25.18 2.78 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 120.767 -1.208 . . . . 0.0 109.714 179.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.724 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 3.5 m 80.03 -87.4 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.682 -0.636 . . . . 0.0 110.559 179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.463 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -46.71 -20.9 0.15 Allowed 'General case' 0 C--N 1.293 -1.88 0 O-C-N 120.358 -1.464 . . . . 0.0 108.615 178.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.51 ' N ' ' O ' ' A' ' 4' ' ' THR . 80.1 m -92.49 -65.66 0.98 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.458 -0.776 . . . . 0.0 110.647 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.509 ' SG ' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -67.49 -32.87 73.98 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.305 -0.872 . . . . 0.0 108.956 179.915 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -66.31 -55.03 17.97 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.402 -0.811 . . . . 0.0 109.015 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.449 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 79.5 m -57.95 -28.65 64.5 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 118.918 -1.113 . . . . 0.0 108.596 178.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.438 ' HG2' ' O ' ' A' ' 6' ' ' THR . 10.4 mm-40 -88.49 -11.25 46.37 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 121.542 -0.724 . . . . 0.0 110.149 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.534 ' O ' ' CB ' ' A' ' 14' ' ' ASN . 21.4 ttp180 -89.92 -48.35 7.28 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 12' ' ' LEU . 10.8 mt -61.52 -43.96 97.92 Favored 'General case' 0 C--N 1.291 -1.975 0 CA-C-N 114.647 -1.16 . . . . 0.0 107.955 176.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.553 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.13 -22.48 66.94 Favored 'General case' 0 C--N 1.302 -1.478 0 N-CA-C 108.176 -1.046 . . . . 0.0 108.176 178.227 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.534 ' CB ' ' O ' ' A' ' 11' ' ' ARG . 21.8 t30 -58.17 -49.36 77.29 Favored 'General case' 0 N--CA 1.485 1.277 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 179.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 1.6 m-30 -63.82 -24.72 67.86 Favored 'General case' 0 C--N 1.307 -1.263 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 178.104 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -63.1 -49.92 72.53 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.672 -0.811 . . . . 0.0 109.397 179.377 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 10.2 t -81.46 -31.43 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.441 -0.787 . . . . 0.0 109.942 179.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 35.6 m-70 -74.08 -57.12 4.17 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.412 -0.805 . . . . 0.0 110.187 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.459 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -69.48 -17.35 63.6 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.995 -179.931 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.613 ' HA ' ' CE2' ' A' ' 23' ' ' PHE . 1.2 t -67.87 -48.16 66.88 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.249 -0.907 . . . . 0.0 110.383 179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -67.74 -29.49 68.73 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.419 -0.8 . . . . 0.0 110.316 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.534 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.1 OUTLIER -64.4 -65.68 0.64 Allowed 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.771 179.66 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.723 ' CD1' HD22 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -68.01 -19.53 64.93 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.358 -0.839 . . . . 0.0 109.706 179.804 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -75.75 -32.32 54.15 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 108.284 -1.926 . . . . 0.0 108.284 178.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.716 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -73.98 -19.16 60.74 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.63 -0.924 . . . . 0.0 110.223 179.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.829 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -89.96 -48.51 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.723 HD22 ' CD1' ' A' ' 23' ' ' PHE . 4.8 mp -49.34 -24.86 2.07 Favored 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 175.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.477 ' O ' ' OG ' ' A' ' 29' ' ' SER . 5.7 m -73.96 3.88 6.19 Favored 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.722 179.073 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 26' ' ' ILE . 3.5 m -167.23 54.3 0.07 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.087 -1.008 . . . . 0.0 109.456 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.515 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.1 OUTLIER -113.14 -82.09 0.59 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.475 -0.766 . . . . 0.0 110.438 -179.426 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.515 ' H ' HG23 ' A' ' 30' ' ' THR . 0.4 OUTLIER -140.58 5.43 2.01 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.386 -0.821 . . . . 0.0 110.769 -179.543 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.445 HG22 ' O ' ' A' ' 32' ' ' VAL . 8.9 p -70.79 -1.93 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.101 -0.999 . . . . 0.0 110.25 179.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.44 ' O ' ' O ' ' A' ' 34' ' ' SER . . . 173.8 -72.37 0.09 OUTLIER Glycine 0 N--CA 1.491 2.329 0 N-CA-C 109.268 -1.533 . . . . 0.0 109.268 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.44 ' O ' ' O ' ' A' ' 33' ' ' GLY . 0.7 OUTLIER 57.29 113.91 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.347 -1.09 . . . . 0.0 110.482 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.427 ' C ' ' OG1' ' A' ' 36' ' ' THR . 55.1 t30 -73.71 62.15 0.79 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.298 -0.876 . . . . 0.0 109.913 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.427 ' OG1' ' C ' ' A' ' 35' ' ' ASN . 0.2 OUTLIER -162.87 65.69 0.2 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.22 -0.925 . . . . 0.0 110.329 -179.633 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 27.4 p90 . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.161 179.909 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.41 0.624 . . . . 0.0 110.138 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.534 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.3 OUTLIER -53.38 -83.75 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 0.0 110.624 -179.959 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.534 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 8.0 t-20 163.35 -27.58 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 -179.432 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.527 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -120.8 121.69 38.72 Favored 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 178.636 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.55 -25.9 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 CA-C-O 121.62 0.724 . . . . 0.0 109.76 -179.949 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.602 HG23 ' N ' ' A' ' 7' ' ' CYS . 8.0 t -78.75 -44.61 22.96 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.498 -0.751 . . . . 0.0 109.525 179.051 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.602 ' N ' HG23 ' A' ' 6' ' ' THR . 44.3 t -61.44 -47.16 87.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.463 -0.773 . . . . 0.0 109.185 179.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.577 ' O ' HD12 ' A' ' 12' ' ' LEU . . . -56.95 -48.84 77.36 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.698 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.416 ' O ' ' N ' ' A' ' 13' ' ' ALA . 17.5 m -63.11 -42.48 99.58 Favored 'General case' 0 N--CA 1.487 1.398 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.687 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' HB3' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -66.29 -20.8 66.2 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 121.477 -0.764 . . . . 0.0 109.804 179.376 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 6.3 tpp180 -90.04 -48.87 6.92 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 178.551 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.577 HD12 ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -58.77 -31.81 68.72 Favored 'General case' 0 C--N 1.292 -1.916 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.825 176.669 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.62 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -73.39 -27.99 61.77 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.796 0.808 . . . . 0.0 108.998 179.013 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 6.5 t-20 -60.45 -43.19 97.1 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.759 -0.588 . . . . 0.0 109.822 179.484 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.566 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -88.16 -16.53 33.13 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.628 -0.829 . . . . 0.0 109.162 179.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.62 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.3 mt -70.53 -49.29 49.69 Favored 'General case' 0 N--CA 1.492 1.646 0 C-N-CA 119.394 -0.922 . . . . 0.0 109.815 -179.863 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.458 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 29.8 t -76.66 -36.43 27.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.413 -0.805 . . . . 0.0 109.852 179.585 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.538 ' HA ' ' HB2' ' A' ' 22' ' ' ASN . 27.5 m-70 -77.93 -55.78 5.03 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.455 -0.778 . . . . 0.0 111.279 -179.645 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.509 ' O ' ' HB3' ' A' ' 23' ' ' PHE . 0.9 OUTLIER -75.76 -36.73 59.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.269 -0.894 . . . . 0.0 112.358 -178.047 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 0.4 OUTLIER -92.17 -40.9 10.75 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.758 -1.214 . . . . 0.0 112.456 -178.618 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.693 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -91.35 -38.65 12.48 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 120.995 -1.066 . . . . 0.0 112.83 -177.837 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.538 ' HB2' ' HA ' ' A' ' 18' ' ' HIS . 0.6 OUTLIER -78.06 -41.14 36.46 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.798 -1.189 . . . . 0.0 111.667 -178.155 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.519 ' CD1' ' N ' ' A' ' 24' ' ' GLY . 0.0 OUTLIER -59.46 -43.16 93.24 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.191 -0.943 . . . . 0.0 109.767 -179.6 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -84.05 -13.81 73.63 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.474 -1.451 . . . . 0.0 109.474 -179.813 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.744 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -72.55 -27.94 62.53 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -1.1 . . . . 0.0 110.539 -179.718 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.86 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.6 mm -91.4 -47.73 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 N-CA-C 107.484 -1.302 . . . . 0.0 107.484 179.646 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.413 ' N ' ' CD2' ' A' ' 27' ' ' LEU . 3.8 mm? -53.84 -22.01 8.79 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 176.036 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 24' ' ' GLY . 1.8 m -72.97 0.06 12.34 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.716 179.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 3.9 m -137.34 45.65 2.19 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.088 -1.007 . . . . 0.0 110.492 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.531 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 26.0 p -131.77 -75.83 0.51 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.434 -0.791 . . . . 0.0 110.283 -179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.531 ' N ' ' OG1' ' A' ' 30' ' ' THR . 1.4 p30 -87.04 -9.35 55.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.203 -0.936 . . . . 0.0 110.39 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.526 HG23 ' OD1' ' A' ' 31' ' ' ASN . 53.9 t -128.27 -76.5 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.312 -0.868 . . . . 0.0 109.968 179.895 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.432 ' C ' ' O ' ' A' ' 32' ' ' VAL . . . 41.15 38.35 1.8 Allowed Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.647 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.465 ' H ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -178.63 -169.91 0.19 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.158 -1.201 . . . . 0.0 110.277 179.924 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.415 ' CB ' ' O ' ' A' ' 34' ' ' SER . 4.5 t-20 63.48 106.11 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.25 -0.906 . . . . 0.0 110.199 -179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.635 HG23 ' O ' ' A' ' 36' ' ' THR . 6.7 t -126.16 78.84 1.8 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.321 -0.862 . . . . 0.0 109.947 179.742 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.473 ' O ' ' O ' ' A' ' 36' ' ' THR . 1.4 p90 . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 117.889 -1.053 . . . . 0.0 110.384 -179.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.2 0.524 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.545 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 0.1 OUTLIER -139.64 -74.79 0.36 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.22 -0.925 . . . . 0.0 110.494 -179.634 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.545 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.4 t30 160.81 -33.62 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -179.373 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.538 ' O ' ' N ' ' A' ' 6' ' ' THR . 0.2 OUTLIER -100.2 119.33 38.2 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.473 -0.785 . . . . 0.0 108.963 178.377 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.507 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -40.52 -23.11 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.826 -0.546 . . . . 0.0 110.177 179.801 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.538 ' N ' ' O ' ' A' ' 4' ' ' THR . 10.0 t -77.65 -41.22 39.05 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.143 -0.973 . . . . 0.0 109.519 179.375 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.499 ' N ' HG23 ' A' ' 6' ' ' THR . 38.3 t -86.13 -48.78 8.29 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.241 -0.912 . . . . 0.0 109.145 178.951 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.439 ' O ' ' HB2' ' A' ' 12' ' ' LEU . . . -54.1 -53.31 54.98 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 179.025 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.507 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 52.3 m -54.33 -42.91 70.74 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.307 -0.957 . . . . 0.0 108.719 178.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -74.23 -18.81 60.69 Favored 'General case' 0 N--CA 1.485 1.296 0 O-C-N 121.312 -0.867 . . . . 0.0 110.653 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.3 mmt85 -90.1 -37.88 13.94 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 179.271 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.9 OUTLIER -68.3 -31.64 71.23 Favored 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.276 177.974 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.567 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -71.83 -32.45 67.55 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.758 0.79 . . . . 0.0 108.869 178.82 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 18.0 t30 -59.04 -44.02 91.72 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-O 121.424 0.63 . . . . 0.0 109.644 179.314 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.639 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.3 OUTLIER -79.78 -16.93 54.6 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.168 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.567 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -68.29 -54.9 14.33 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 119.657 -0.817 . . . . 0.0 109.541 179.586 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.5 t -78.44 -19.86 13.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.332 -0.855 . . . . 0.0 110.105 179.652 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 15.1 m170 -88.6 -56.98 3.08 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.036 179.807 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 5.6 p -62.2 -21.03 64.79 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.432 -0.792 . . . . 0.0 110.587 -179.624 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.591 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 22.8 t -90.79 -37.48 13.61 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.075 -1.015 . . . . 0.0 110.37 -179.977 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 24' ' ' GLY . 16.9 t-20 -85.73 -4.7 59.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.339 -0.85 . . . . 0.0 110.535 -179.737 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.403 ' C ' ' O ' ' A' ' 21' ' ' ASN . 8.1 t-20 -44.86 -52.67 8.33 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.224 -0.923 . . . . 0.0 109.784 179.859 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.631 ' O ' HD13 ' A' ' 27' ' ' LEU . 5.1 p90 -49.61 -29.94 7.97 Favored 'General case' 0 C--N 1.301 -1.518 0 O-C-N 121.455 -0.778 . . . . 0.0 108.936 179.424 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.624 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -79.6 -34.51 31.45 Favored Glycine 0 N--CA 1.487 2.087 0 N-CA-C 109.204 -1.558 . . . . 0.0 109.204 179.693 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.702 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -58.06 -18.51 25.08 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.291 -1.123 . . . . 0.0 109.783 179.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.789 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.3 mm -91.48 -42.07 13.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 179.403 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.631 HD13 ' O ' ' A' ' 23' ' ' PHE . 5.8 mp -52.39 -23.04 5.32 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.616 -1.254 . . . . 0.0 107.616 176.422 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.482 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 3.1 m -66.89 -12.42 59.3 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.51 179.595 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.404 ' C ' HG23 ' A' ' 30' ' ' THR . 0.4 OUTLIER -136.4 45.15 2.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.199 -0.938 . . . . 0.0 110.424 -179.612 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.484 HG23 ' O ' ' A' ' 26' ' ' ILE . 60.5 p -145.52 -76.5 0.21 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.427 -0.796 . . . . 0.0 109.855 179.888 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.517 ' ND2' ' O ' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -53.56 -24.69 14.32 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.303 -0.873 . . . . 0.0 109.641 179.644 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 3.3 t -95.29 -21.75 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.417 -0.802 . . . . 0.0 109.799 179.724 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 60.83 55.72 28.2 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.85 91.28 8.55 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.209 -1.171 . . . . 0.0 110.287 -179.982 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.408 ' O ' ' HB ' ' A' ' 36' ' ' THR . 30.7 p30 -114.2 -176.23 2.85 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.247 -0.908 . . . . 0.0 110.059 179.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.408 ' HB ' ' O ' ' A' ' 35' ' ' ASN . 34.9 m 54.02 89.67 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.209 -0.932 . . . . 0.0 110.168 179.871 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.401 ' C ' ' O ' ' A' ' 36' ' ' THR . 52.2 p90 . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.405 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.445 ' O ' ' C ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.171 0.51 . . . . 0.0 110.129 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.502 ' HB3' ' HB2' ' A' ' 8' ' ' ALA . 48.5 t -41.1 -79.06 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 -179.918 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 6.9 t-20 169.78 -32.0 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 6' ' ' THR . 1.5 m -114.87 117.94 32.11 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.467 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -39.57 -25.43 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.69 -0.631 . . . . 0.0 110.043 -179.972 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.898 HG22 HG22 ' A' ' 4' ' ' THR . 3.0 t -75.48 -34.08 60.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.179 -0.951 . . . . 0.0 110.368 179.68 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 4' ' ' THR . 6.3 t -89.9 -60.86 1.82 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.962 . . . . 0.0 109.641 179.624 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.753 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -44.97 -54.37 6.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.312 -0.867 . . . . 0.0 109.206 179.136 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 27.9 m -59.78 -43.45 94.37 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.458 -0.776 . . . . 0.0 110.076 179.579 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.91 -20.52 65.1 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 121.187 -0.946 . . . . 0.0 110.555 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.617 ' HG3' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.12 -50.07 6.05 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 179.114 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.753 HD12 ' C ' ' A' ' 8' ' ' ALA 0.262 3.2 mt -58.27 -39.75 80.07 Favored 'General case' 0 C--N 1.285 -2.203 0 CA-C-N 114.232 -1.349 . . . . 0.0 109.25 178.101 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.539 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -65.8 -34.29 77.82 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.523 -0.736 . . . . 0.0 109.429 179.246 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.507 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 7.4 t30 -56.24 -44.57 79.74 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.403 -0.81 . . . . 0.0 109.349 179.393 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.621 ' N ' ' CD1' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -85.44 -20.03 30.41 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.229 -0.919 . . . . 0.0 108.877 179.568 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.539 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.0 tp -66.13 -52.71 45.97 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 119.351 -0.94 . . . . 0.0 109.823 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 15.6 t -72.1 -30.88 37.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.163 -0.961 . . . . 0.0 110.29 179.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 19.5 m-70 -89.8 -66.71 0.9 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.109 -0.995 . . . . 0.0 110.878 -179.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.2 t -50.95 -23.69 3.08 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.455 -0.778 . . . . 0.0 111.284 -178.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 9.1 p -90.78 -46.89 7.96 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.863 -1.148 . . . . 0.0 111.43 -179.337 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -84.47 -43.98 14.08 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.138 -0.976 . . . . 0.0 111.396 -178.947 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 26' ' ' ILE . 5.2 t30 -65.41 -12.46 52.53 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.221 -0.924 . . . . 0.0 111.523 -178.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.579 ' O ' HD23 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -76.65 -65.95 0.87 Allowed 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.927 -1.108 . . . . 0.0 110.612 -179.239 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -57.94 -22.16 47.44 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.517 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -70.39 -41.72 72.66 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.252 -1.146 . . . . 0.0 110.741 -179.638 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.606 HG22 HG21 ' A' ' 30' ' ' THR . 7.7 mm -91.64 -42.28 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 121.065 -1.022 . . . . 0.0 108.779 179.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.579 HD23 ' O ' ' A' ' 23' ' ' PHE . 3.9 mm? -46.63 -26.98 1.01 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 176.726 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.477 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.2 m -61.79 -22.61 65.59 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.779 178.845 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.515 ' C ' HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -134.74 44.86 2.61 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.195 -0.94 . . . . 0.0 110.545 -178.964 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.606 HG21 HG22 ' A' ' 26' ' ' ILE . 70.1 p -150.31 -55.51 0.16 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.302 -0.874 . . . . 0.0 110.041 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.493 ' ND2' ' N ' ' A' ' 32' ' ' VAL . 0.0 OUTLIER -54.25 -19.85 5.99 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.39 -0.819 . . . . 0.0 109.52 179.458 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.493 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 9.6 p -55.1 -19.59 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.853 0.835 . . . . 0.0 109.326 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -101.51 -29.07 6.43 Favored Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.301 -1.52 . . . . 0.0 109.301 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 53.0 p 44.32 73.98 0.14 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.347 -1.09 . . . . 0.0 110.304 -179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -154.01 52.49 0.69 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.185 -0.947 . . . . 0.0 110.509 179.783 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -141.01 48.71 1.69 Allowed 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.29 -0.881 . . . . 0.0 110.401 179.85 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.5 p90 . . . . . 0 C--N 1.301 -1.503 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.258 -179.997 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.512 ' O ' ' HB3' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.173 0.511 . . . . 0.0 110.146 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.686 ' HB2' ' N ' ' A' ' 7' ' ' CYS . 5.4 p 169.63 114.75 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 O-C-N 121.509 -0.745 . . . . 0.0 109.02 179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.693 ' O ' ' CB ' ' A' ' 4' ' ' THR . 6.8 t30 -100.52 15.26 28.56 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.319 -0.863 . . . . 0.0 112.385 -178.443 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.78 HG22 ' N ' ' A' ' 5' ' ' ALA . 1.8 m 139.52 -87.88 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 118.686 0.676 . . . . 0.0 110.638 178.583 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.78 ' N ' HG22 ' A' ' 4' ' ' THR . . . -43.53 -22.93 0.05 Allowed 'General case' 0 C--N 1.295 -1.774 0 O-C-N 120.567 -1.333 . . . . 0.0 108.995 179.58 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.547 ' HB ' ' CB ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -92.68 -57.96 2.5 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.569 -0.707 . . . . 0.0 110.907 179.507 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.686 ' N ' ' HB2' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -77.76 -37.34 49.3 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 -179.794 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.748 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -62.56 -52.4 63.56 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 178.556 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.407 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 31.8 m -59.84 -26.42 65.8 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.06 -1.025 . . . . 0.0 109.267 179.136 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.487 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -89.96 -17.81 27.22 Favored 'General case' 0 C--N 1.307 -1.25 0 O-C-N 121.441 -0.787 . . . . 0.0 110.69 179.961 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -91.2 -39.44 12.1 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.597 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.604 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 2.0 mt -61.96 -49.04 77.69 Favored 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.639 -1.164 . . . . 0.0 108.696 177.68 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.468 ' O ' ' CB ' ' A' ' 16' ' ' LEU . . . -65.31 -27.79 68.86 Favored 'General case' 0 C--N 1.301 -1.506 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.498 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 10' ' ' GLN . 26.4 t-20 -61.38 -46.48 90.01 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 178.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 3.9 m-85 -62.71 -21.41 65.76 Favored 'General case' 0 C--N 1.306 -1.315 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 178.159 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.468 ' CB ' ' O ' ' A' ' 13' ' ' ALA . 0.1 OUTLIER -65.77 -53.76 36.06 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.73 -0.788 . . . . 0.0 109.708 179.336 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -80.24 -24.01 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.194 -0.941 . . . . 0.0 109.902 179.669 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.435 ' O ' ' N ' ' A' ' 22' ' ' ASN . 11.0 m170 -85.63 -62.2 1.58 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.297 -0.877 . . . . 0.0 109.968 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.543 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 4.7 p -51.48 -38.59 54.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.192 -0.943 . . . . 0.0 109.749 179.802 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.595 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 45.3 t -65.05 -45.31 85.89 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.385 -0.822 . . . . 0.0 109.682 179.57 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.34 7.39 38.72 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.358 -0.838 . . . . 0.0 110.057 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.463 ' O ' HG12 ' A' ' 26' ' ' ILE . 4.9 t30 -67.92 -60.71 2.3 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.295 -0.878 . . . . 0.0 110.298 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.692 ' HD1' HD22 ' A' ' 27' ' ' LEU . 4.8 p90 -53.26 -24.45 11.43 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.313 -0.867 . . . . 0.0 109.615 179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.505 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -73.44 -36.97 54.11 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.038 -1.625 . . . . 0.0 109.038 179.488 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.682 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -69.22 -16.88 63.7 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.336 -1.096 . . . . 0.0 109.775 179.768 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.783 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.2 mm -91.88 -50.2 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 178.958 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.692 HD22 ' HD1' ' A' ' 23' ' ' PHE . 3.0 mp -50.56 -24.95 3.58 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.803 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.497 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 1.1 m -56.03 -23.44 33.16 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-O 121.388 0.613 . . . . 0.0 109.92 179.047 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.62 17.88 6.01 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.416 -0.802 . . . . 0.0 109.987 -179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.539 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 20.5 p -137.21 -75.15 0.41 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.258 -0.901 . . . . 0.0 110.342 -179.89 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.539 ' N ' ' OG1' ' A' ' 30' ' ' THR . 0.0 OUTLIER -53.92 -19.89 5.25 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.178 -0.951 . . . . 0.0 109.445 179.668 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.435 ' HB ' ' O ' ' A' ' 28' ' ' SER . 24.9 t -115.26 -31.2 1.98 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.538 -0.727 . . . . 0.0 109.845 179.732 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -92.13 7.67 78.35 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 -179.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.482 ' CB ' ' O ' ' A' ' 30' ' ' THR . 24.7 t -113.8 39.89 2.57 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.243 -1.151 . . . . 0.0 110.091 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.44 ' O ' ' O ' ' A' ' 36' ' ' THR . 0.0 OUTLIER -78.17 151.64 33.13 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.274 -0.891 . . . . 0.0 110.424 -179.922 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.44 ' O ' ' O ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER 50.02 100.65 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.303 -0.873 . . . . 0.0 110.317 179.976 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 2.9 p90 . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.169 179.92 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.8 ttmt . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.122 0.487 . . . . 0.0 110.143 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 1.6 p -78.92 -106.09 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.15 -0.969 . . . . 0.0 110.121 179.59 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.7 t-20 178.55 26.23 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.576 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.3 OUTLIER -144.69 95.8 2.76 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 179.962 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.481 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -33.14 -31.24 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 121.022 0.439 . . . . 0.0 110.416 -179.441 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.588 HG23 ' N ' ' A' ' 7' ' ' CYS . 7.2 t -62.32 -45.56 92.66 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.035 -1.041 . . . . 0.0 108.426 178.215 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.588 ' N ' HG23 ' A' ' 6' ' ' THR . 0.0 OUTLIER -67.69 -55.98 11.1 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.71 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.534 ' C ' HD12 ' A' ' 12' ' ' LEU . . . -50.85 -57.79 7.59 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.014 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.542 ' O ' ' HB2' ' A' ' 13' ' ' ALA . 15.0 m -54.39 -36.45 63.93 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.326 -0.859 . . . . 0.0 109.553 179.244 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.481 ' HB3' ' O ' ' A' ' 7' ' ' CYS . 3.3 tp-100 -65.2 -32.05 73.54 Favored 'General case' 0 N--CA 1.487 1.398 0 O-C-N 121.297 -0.877 . . . . 0.0 110.319 179.866 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 15.0 tpp180 -87.07 -48.0 8.45 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 105.916 -1.883 . . . . 0.0 105.916 178.338 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 8' ' ' ALA . 2.1 mt -52.05 -37.57 54.1 Favored 'General case' 0 C--N 1.291 -1.951 0 CA-C-N 114.678 -1.146 . . . . 0.0 108.011 176.541 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.595 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -58.42 -43.94 88.86 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.464 0.649 . . . . 0.0 109.586 179.156 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.461 ' HB3' ' CE1' ' A' ' 15' ' ' PHE . 2.3 t30 -49.28 -43.55 43.25 Favored 'General case' 0 C--N 1.301 -1.521 0 N-CA-C 108.902 -0.777 . . . . 0.0 108.902 179.251 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.558 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 0.4 OUTLIER -90.2 -19.29 24.37 Favored 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.451 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.595 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.3 OUTLIER -67.97 -36.54 80.24 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 119.345 -0.942 . . . . 0.0 109.45 -179.919 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 23.7 t -85.17 -34.26 8.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 O-C-N 121.366 -0.833 . . . . 0.0 108.849 178.729 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -78.98 -53.75 6.72 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.482 -0.761 . . . . 0.0 110.004 179.539 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 15.5 t -61.98 -39.62 92.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.268 -0.895 . . . . 0.0 109.907 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.513 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 12.9 t -56.51 -43.92 80.24 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.298 -0.876 . . . . 0.0 109.293 179.502 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -51.27 -42.31 61.0 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 121.699 0.761 . . . . 0.0 109.295 179.119 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.495 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.4 OUTLIER -84.34 -45.69 12.52 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.499 -0.75 . . . . 0.0 109.863 179.594 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.507 ' HB3' ' HA ' ' A' ' 20' ' ' SER . 38.9 t80 -51.52 -25.3 6.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.52 -0.737 . . . . 0.0 109.853 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.459 ' O ' ' HB2' ' A' ' 27' ' ' LEU . . . -86.93 -39.32 7.55 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.529 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -58.54 -23.22 57.81 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.101 -1.235 . . . . 0.0 110.299 -179.834 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.601 ' N ' HD13 ' A' ' 26' ' ' ILE . 5.0 mm -91.76 -34.1 6.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 179.345 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.571 ' HA ' HG21 ' A' ' 30' ' ' THR . 0.1 OUTLIER -53.2 -20.32 3.88 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 176.267 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.1 m -71.07 1.41 5.81 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.91 179.464 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -146.78 52.15 1.1 Allowed 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.167 -0.958 . . . . 0.0 109.3 -179.746 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.571 HG21 ' HA ' ' A' ' 27' ' ' LEU . 55.2 p -122.86 -74.7 0.61 Allowed 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.633 -0.667 . . . . 0.0 111.262 -178.704 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' OG1' ' A' ' 30' ' ' THR . 2.8 t-20 -131.28 26.54 4.83 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.355 -0.841 . . . . 0.0 110.862 -179.327 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.535 HG22 ' H ' ' A' ' 34' ' ' SER . 3.7 p -50.06 -36.46 12.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.009 -1.057 . . . . 0.0 109.075 179.526 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.462 ' O ' ' C ' ' A' ' 34' ' ' SER . . . 64.01 6.19 17.86 Favored Glycine 0 N--CA 1.493 2.492 0 N-CA-C 110.921 -0.872 . . . . 0.0 110.921 179.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.535 ' H ' HG22 ' A' ' 32' ' ' VAL . 80.3 p 39.23 54.39 2.21 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.052 -1.264 . . . . 0.0 110.642 -179.998 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.532 ' O ' ' C ' ' A' ' 36' ' ' THR . 63.6 m-20 59.63 162.44 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.164 -0.96 . . . . 0.0 110.5 179.874 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 36' ' ' THR . 10.6 t 21.65 98.67 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.167 0 CA-C-O 121.263 0.554 . . . . 0.0 111.847 -179.99 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.509 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 7.9 p90 . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.976 -1.011 . . . . 0.0 110.303 179.94 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.222 0.534 . . . . 0.0 110.258 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 14.8 t -147.12 -87.58 0.09 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.263 -0.898 . . . . 0.0 110.047 179.894 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.482 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 7.7 t-20 179.18 -5.74 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.195 -0.941 . . . . 0.0 111.708 179.836 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.852 ' OG1' HG22 ' A' ' 6' ' ' THR . 1.7 t 176.11 121.35 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.326 0 O-C-N 121.0 -1.062 . . . . 0.0 109.12 -179.666 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.401 ' O ' ' OG1' ' A' ' 9' ' ' THR . . . -40.06 -17.09 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.799 -0.563 . . . . 0.0 111.597 -179.814 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.852 HG22 ' OG1' ' A' ' 4' ' ' THR . 8.8 t -77.5 -30.52 53.04 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 120.853 -1.155 . . . . 0.0 108.033 178.815 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.611 ' HB3' HG23 ' A' ' 4' ' ' THR . 10.6 p -83.96 -36.3 23.34 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 115.518 -0.765 . . . . 0.0 108.961 179.249 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.647 ' O ' HD23 ' A' ' 12' ' ' LEU . . . -64.19 -44.06 93.15 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.581 -0.699 . . . . 0.0 109.673 179.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.401 ' OG1' ' O ' ' A' ' 5' ' ' ALA . 0.2 OUTLIER -75.54 -35.74 60.62 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.399 -0.92 . . . . 0.0 109.082 179.13 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.519 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.2 tp60 -81.04 -19.77 43.11 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.38 -0.825 . . . . 0.0 110.955 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.597 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 10.9 tpp180 -87.49 -41.92 13.16 Favored 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 106.294 -1.743 . . . . 0.0 106.294 178.94 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.647 HD23 ' O ' ' A' ' 8' ' ' ALA . 2.2 mm? -56.09 -31.57 63.35 Favored 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.396 176.649 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.616 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.07 -33.18 73.14 Favored 'General case' 0 N--CA 1.484 1.265 0 CA-C-O 121.766 0.793 . . . . 0.0 109.097 179.073 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -57.09 -47.45 81.01 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.053 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.597 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 2.9 m-85 -70.44 -22.78 62.67 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 178.465 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.616 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 2.5 tp -51.16 -34.02 29.54 Favored 'General case' 0 C--N 1.306 -1.315 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 178.922 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.409 ' O ' ' HB3' ' A' ' 20' ' ' SER . 86.2 t -90.97 -55.33 6.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 C-N-CA 119.966 -0.694 . . . . 0.0 110.112 179.002 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.472 ' O ' ' OD1' ' A' ' 21' ' ' ASN . 10.8 m170 -61.3 -39.56 90.91 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.23 -0.919 . . . . 0.0 110.391 -179.951 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 15' ' ' PHE . 0.2 OUTLIER -80.61 -31.39 36.67 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.406 -0.809 . . . . 0.0 108.819 179.249 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 0.1 OUTLIER -45.28 -43.57 10.7 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.04 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.49 ' OD1' ' N ' ' A' ' 22' ' ' ASN . 10.6 p-10 -44.84 -32.15 1.47 Allowed 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 179.093 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.49 ' N ' ' OD1' ' A' ' 21' ' ' ASN . 3.3 t-20 -80.43 -51.35 8.93 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.209 178.993 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.737 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -54.48 -32.48 57.88 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.529 -0.732 . . . . 0.0 109.052 179.037 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.453 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -84.74 -19.58 59.54 Favored Glycine 0 N--CA 1.488 2.122 0 N-CA-C 109.399 -1.48 . . . . 0.0 109.399 179.848 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.732 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -67.84 -25.17 65.41 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.317 -1.108 . . . . 0.0 109.733 179.657 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.835 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.7 mm -91.42 -37.3 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 179.005 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.737 HD13 ' O ' ' A' ' 23' ' ' PHE . 7.6 mp -70.56 -6.56 37.36 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 175.728 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.657 ' O ' HG21 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -79.33 5.76 11.68 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 121.565 0.697 . . . . 0.0 109.43 178.632 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.98 33.9 3.86 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.252 -0.905 . . . . 0.0 108.681 179.691 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.711 HG23 ' H ' ' A' ' 31' ' ' ASN . 0.0 OUTLIER -168.28 -61.39 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.774 0.797 . . . . 0.0 110.74 -178.676 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.711 ' H ' HG23 ' A' ' 30' ' ' THR . 0.0 OUTLIER -72.25 1.97 6.79 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.584 -0.697 . . . . 0.0 109.989 179.914 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.657 HG21 ' O ' ' A' ' 28' ' ' SER . 6.5 t -74.3 11.48 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.892 0 O-C-N 121.12 -0.987 . . . . 0.0 110.454 -179.985 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -84.89 32.88 3.39 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.786 -1.326 . . . . 0.0 109.786 179.502 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -102.7 28.24 6.26 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.113 -1.228 . . . . 0.0 109.766 179.762 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 51.49 58.17 5.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.477 -0.764 . . . . 0.0 110.178 -179.724 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.785 HG22 ' O ' ' A' ' 36' ' ' THR . 38.3 m -133.22 45.77 2.67 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.336 -0.853 . . . . 0.0 110.121 179.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.501 ' CD1' ' O ' ' A' ' 37' ' ' TYR . 10.3 p90 . . . . . 0 C--N 1.302 -1.467 0 CA-C-O 117.95 -1.024 . . . . 0.0 110.217 -179.959 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 5.4 pttp . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.32 0.581 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.634 ' HB3' ' HB2' ' A' ' 8' ' ' ALA . 38.0 t -59.38 -95.13 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.456 -0.778 . . . . 0.0 109.48 179.649 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.491 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 33.2 t30 178.7 -32.02 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.951 0 O-C-N 120.913 -1.117 . . . . 0.0 108.876 179.336 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.884 ' HB ' HG22 ' A' ' 6' ' ' THR . 2.9 p -126.4 119.52 27.49 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.228 179.208 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.464 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -45.22 -14.95 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.179 -0.951 . . . . 0.0 110.993 179.834 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.884 HG22 ' HB ' ' A' ' 4' ' ' THR . 6.0 t -86.06 -28.42 24.12 Favored 'General case' 0 N--CA 1.486 1.346 0 O-C-N 121.003 -1.061 . . . . 0.0 109.709 179.934 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.533 ' SG ' ' N ' ' A' ' 8' ' ' ALA . 14.8 p -88.67 -36.14 16.39 Favored 'General case' 0 C--N 1.297 -1.713 0 O-C-N 121.613 -0.68 . . . . 0.0 110.085 -179.455 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.634 ' HB2' ' HB3' ' A' ' 2' ' ' CYS . . . -72.85 -61.09 1.93 Allowed 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 179.731 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.511 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 0.4 OUTLIER -56.72 -31.99 65.06 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.324 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -76.0 -24.89 55.34 Favored 'General case' 0 N--CA 1.484 1.245 0 O-C-N 120.784 -1.198 . . . . 0.0 110.591 -179.641 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.6 OUTLIER -91.15 -44.07 9.48 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.695 -1.594 . . . . 0.0 106.695 178.641 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.512 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 0.3 OUTLIER -61.96 -43.19 99.35 Favored 'General case' 0 C--N 1.292 -1.915 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.568 178.003 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.512 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -66.35 -29.86 70.14 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.447 -0.783 . . . . 0.0 109.403 179.263 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.83 -44.02 97.69 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.55 ' O ' ' CB ' ' A' ' 19' ' ' SER . 1.0 OUTLIER -72.59 -20.84 61.23 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 178.787 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' A' ' 20' ' ' SER . 0.2 OUTLIER -61.76 -39.68 92.48 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.573 179.489 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 13.8 t -86.1 -44.85 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 C-N-CA 119.278 -0.969 . . . . 0.0 109.787 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 17.6 m-70 -71.66 -51.22 24.22 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.537 -0.727 . . . . 0.0 110.997 -179.718 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.568 ' HA ' ' HB2' ' A' ' 22' ' ' ASN . 1.9 t -67.43 -42.05 83.8 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.211 -0.931 . . . . 0.0 110.838 -179.411 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.624 ' O ' ' CE2' ' A' ' 23' ' ' PHE . 3.3 m -49.38 -55.52 12.68 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.96 -1.087 . . . . 0.0 109.837 -179.93 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -83.18 5.72 21.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.91 -1.119 . . . . 0.0 109.886 179.415 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.568 ' HB2' ' HA ' ' A' ' 19' ' ' SER . 26.1 t-20 -74.96 -46.71 33.66 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.261 -0.899 . . . . 0.0 110.943 -179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.873 ' O ' HD22 ' A' ' 27' ' ' LEU . 3.0 p90 -49.11 -26.26 2.62 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.094 -1.004 . . . . 0.0 109.435 -179.514 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.577 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -77.76 -41.94 18.17 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 109.064 -1.614 . . . . 0.0 109.064 179.47 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.55 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -67.98 -24.4 65.14 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.436 -1.037 . . . . 0.0 111.221 -179.777 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.637 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.2 mm -91.73 -44.14 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 120.875 -1.141 . . . . 0.0 108.726 179.767 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.873 HD22 ' O ' ' A' ' 23' ' ' PHE . 1.3 mp -48.2 -26.45 1.94 Allowed 'General case' 0 C--N 1.296 -1.754 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 176.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.2 m -59.84 -32.81 71.02 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.913 0.863 . . . . 0.0 108.889 178.335 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.645 ' O ' ' HB ' ' A' ' 30' ' ' THR . 20.6 m -138.68 -81.03 0.32 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -179.998 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.645 ' HB ' ' O ' ' A' ' 29' ' ' SER . 5.3 t 142.71 -44.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.513 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 -179.868 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.605 ' N ' HG23 ' A' ' 30' ' ' THR . 0.0 OUTLIER -160.04 -16.17 0.06 Allowed 'General case' 0 C--N 1.295 -1.79 0 CA-C-N 115.107 -0.951 . . . . 0.0 111.292 179.611 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.51 ' N ' ' ND2' ' A' ' 31' ' ' ASN . 88.6 t -66.67 -6.88 4.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.618 -1.301 . . . . 0.0 110.17 -179.483 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.465 ' O ' ' O ' ' A' ' 34' ' ' SER . . . 114.56 114.64 3.06 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.326 -1.51 . . . . 0.0 109.326 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' CB ' ' A' ' 35' ' ' ASN . 3.0 m -55.56 -159.89 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.365 -1.079 . . . . 0.0 110.697 -179.663 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.485 ' CB ' ' O ' ' A' ' 34' ' ' SER . 1.4 t-20 69.16 129.2 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.331 -0.856 . . . . 0.0 110.202 -179.895 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.564 ' O ' ' C ' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -63.22 103.39 0.48 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.211 -0.93 . . . . 0.0 110.234 -179.925 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.59 ' OXT' ' CG ' ' A' ' 37' ' ' TYR . 15.0 p90 . . . . . 0 N--CA 1.497 1.878 0 CA-C-O 117.947 -1.025 . . . . 0.0 112.641 179.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 121.269 0.557 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.516 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 0.8 OUTLIER -136.05 -84.47 0.37 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.14 -0.975 . . . . 0.0 110.694 -179.729 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 3.5 t30 166.34 -28.13 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -179.516 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.55 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.2 OUTLIER -72.78 105.12 4.21 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 121.604 0.716 . . . . 0.0 109.792 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' THR . . . -39.86 -22.32 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.307 -0.871 . . . . 0.0 110.923 179.513 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.595 HG23 ' N ' ' A' ' 7' ' ' CYS . 10.0 t -80.44 -38.13 30.68 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.01 -1.056 . . . . 0.0 108.16 179.122 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.595 ' N ' HG23 ' A' ' 6' ' ' THR . 11.7 p -82.18 -37.31 26.3 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.339 179.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.508 ' N ' ' SG ' ' A' ' 7' ' ' CYS . . . -59.54 -64.32 0.99 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.344 -0.848 . . . . 0.0 108.783 178.909 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 2.2 m -53.05 -39.1 63.01 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 178.442 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -68.53 -20.72 64.58 Favored 'General case' 0 C--N 1.307 -1.267 0 O-C-N 121.606 -0.683 . . . . 0.0 109.705 179.203 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.584 ' HG3' ' CZ ' ' A' ' 15' ' ' PHE . 5.6 tpm_? -89.76 -49.15 6.8 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 105.769 -1.937 . . . . 0.0 105.769 178.127 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.2 mp -54.79 -35.93 64.37 Favored 'General case' 0 C--N 1.294 -1.809 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 176.36 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -69.95 -27.18 64.53 Favored 'General case' 0 C--N 1.304 -1.401 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.359 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.9 t30 -58.75 -45.55 89.44 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.671 -0.643 . . . . 0.0 109.565 179.304 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.584 ' CZ ' ' HG3' ' A' ' 11' ' ' ARG . 1.5 m-85 -77.64 -17.49 57.7 Favored 'General case' 0 N--CA 1.488 1.468 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 179.031 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.574 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 4.9 tp -66.99 -48.27 68.96 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.587 -0.845 . . . . 0.0 109.433 179.554 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.536 ' O ' ' CB ' ' A' ' 21' ' ' ASN . 57.2 t -87.03 -35.66 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.286 -0.884 . . . . 0.0 109.983 179.457 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.476 ' HB2' ' O ' ' A' ' 14' ' ' ASN . 26.5 m170 -67.48 -49.42 63.64 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.154 -0.966 . . . . 0.0 110.048 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 8.9 t -73.68 -25.91 60.47 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.305 -0.872 . . . . 0.0 110.385 -179.749 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.493 ' HB3' ' O ' ' A' ' 16' ' ' LEU . 39.2 t -89.74 -36.06 15.39 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.153 -0.967 . . . . 0.0 110.346 -179.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.536 ' CB ' ' O ' ' A' ' 17' ' ' VAL . 1.3 t30 -61.68 -22.57 65.43 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.93 . . . . 0.0 110.036 -179.797 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -52.45 -71.1 0.07 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.995 -1.065 . . . . 0.0 110.214 -179.955 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.47 ' CE2' ' O ' ' A' ' 20' ' ' SER . 9.2 p90 -62.07 -26.83 68.5 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.148 -0.97 . . . . 0.0 110.163 -179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -76.07 -28.57 60.19 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.096 -1.602 . . . . 0.0 109.096 179.455 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.702 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -68.87 -25.57 64.69 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.336 -1.096 . . . . 0.0 109.613 179.548 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.816 ' N ' HD13 ' A' ' 26' ' ' ILE . 2.0 mm -90.36 -42.47 14.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 107.666 -1.235 . . . . 0.0 107.666 179.398 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.468 ' HA ' ' CG2' ' A' ' 30' ' ' THR 0.255 0.1 OUTLIER -55.51 -20.43 12.9 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 107.148 -1.427 . . . . 0.0 107.148 176.03 . . . . . . . . 4 4 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 4.0 m -76.34 9.91 2.35 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.885 179.607 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 49.9 m -161.79 46.45 0.17 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 120.895 -1.128 . . . . 0.0 110.532 -179.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.562 ' OG1' ' N ' ' A' ' 31' ' ' ASN . 3.2 p -88.83 -66.31 0.93 Allowed 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.496 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.788 ' O ' HG12 ' A' ' 32' ' ' VAL . 0.7 OUTLIER -88.04 -8.77 55.08 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 177.74 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.788 HG12 ' O ' ' A' ' 31' ' ' ASN . 6.1 p 43.45 35.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 CA-C-O 121.865 0.841 . . . . 0.0 109.801 179.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 35' ' ' ASN . . . 52.49 54.59 26.58 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.766 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.38 87.9 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.221 -1.164 . . . . 0.0 109.894 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.483 ' N ' ' O ' ' A' ' 33' ' ' GLY . 0.8 OUTLIER -115.25 58.49 0.72 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.303 -0.873 . . . . 0.0 110.595 -179.531 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.557 HG23 ' O ' ' A' ' 36' ' ' THR . 2.9 t -55.92 108.44 0.45 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.084 -1.01 . . . . 0.0 109.846 179.677 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.461 ' C ' ' O ' ' A' ' 36' ' ' THR . 15.7 p90 . . . . . 0 N--CA 1.497 1.909 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.686 -179.757 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.2 mtpt . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.193 0.521 . . . . 0.0 110.328 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.55 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 29.0 m -152.26 -91.48 0.05 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.193 -0.942 . . . . 0.0 110.397 179.84 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.55 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 3.9 t30 158.79 -24.11 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 -179.443 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.615 ' OG1' HG22 ' A' ' 6' ' ' THR . 0.8 OUTLIER -122.18 118.64 29.09 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.34 0.591 . . . . 0.0 109.411 179.532 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.557 ' O ' ' CB ' ' A' ' 9' ' ' THR . . . -38.28 -27.47 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.451 0 CA-C-O 121.108 0.48 . . . . 0.0 110.003 179.882 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.615 HG22 ' OG1' ' A' ' 4' ' ' THR . 2.6 t -62.1 -39.33 92.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.979 . . . . 0.0 108.709 179.193 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.527 ' N ' ' O ' ' A' ' 4' ' ' THR . 44.9 t -86.49 -48.6 8.25 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 178.673 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' A' ' 5' ' ' ALA . . . -57.45 -56.69 18.59 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.547 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.557 ' CB ' ' O ' ' A' ' 5' ' ' ALA . 88.8 m -48.75 -44.21 38.41 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 118.821 -1.152 . . . . 0.0 108.224 178.456 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.01 -22.93 67.2 Favored 'General case' 0 N--CA 1.486 1.362 0 O-C-N 121.356 -0.84 . . . . 0.0 109.676 178.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 8' ' ' ALA . 0.4 OUTLIER -88.34 -45.08 10.31 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 178.792 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.579 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 3.8 mm? -56.61 -41.77 77.63 Favored 'General case' 0 C--N 1.29 -2.002 0 CA-C-N 114.616 -1.175 . . . . 0.0 108.578 176.558 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.557 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -62.83 -31.79 72.87 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.15 -44.91 68.15 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.63 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.579 ' CD2' ' HA ' ' A' ' 12' ' ' LEU . 1.1 m-85 -67.1 -24.52 65.94 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 178.192 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 13' ' ' ALA . 0.2 OUTLIER -67.39 -40.87 85.68 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.204 -0.998 . . . . 0.0 109.176 179.722 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.491 ' O ' ' ND2' ' A' ' 21' ' ' ASN . 20.9 t -77.17 -33.31 20.04 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 O-C-N 121.352 -0.843 . . . . 0.0 109.394 179.131 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.497 ' HA ' ' HB2' ' A' ' 21' ' ' ASN . 7.6 m170 -86.49 -63.53 1.3 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.447 -0.783 . . . . 0.0 110.294 179.944 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.539 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 2.2 t -49.2 -33.5 12.56 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.416 -0.803 . . . . 0.0 109.587 -179.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.609 ' O ' ' CD1' ' A' ' 23' ' ' PHE . 7.3 t -85.46 -21.95 28.48 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.323 -0.861 . . . . 0.0 108.818 178.958 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' A' ' 24' ' ' GLY . 0.5 OUTLIER -71.15 -17.72 62.53 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.491 -0.756 . . . . 0.0 110.019 179.397 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.438 ' C ' ' O ' ' A' ' 21' ' ' ASN . 4.6 t-20 -39.88 -65.33 0.4 Allowed 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.299 -0.876 . . . . 0.0 110.601 -179.938 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.609 ' CD1' ' O ' ' A' ' 20' ' ' SER . 0.2 OUTLIER -53.29 -19.83 3.66 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.096 -1.002 . . . . 0.0 109.544 179.684 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.569 ' N ' ' CD1' ' A' ' 23' ' ' PHE . . . -82.46 -34.96 21.47 Favored Glycine 0 N--CA 1.487 2.094 0 N-CA-C 108.012 -2.035 . . . . 0.0 108.012 178.655 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 28' ' ' SER . . . -62.85 -13.95 40.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.522 -0.987 . . . . 0.0 109.112 178.952 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.611 ' N ' HD13 ' A' ' 26' ' ' ILE . 4.8 mm -91.33 -40.3 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 107.713 -1.217 . . . . 0.0 107.713 178.581 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.487 HD12 ' HA2' ' A' ' 24' ' ' GLY . 11.8 mt -48.06 -27.77 2.48 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 176.885 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.509 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 2.3 m -50.21 -30.8 12.35 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.968 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.773 ' C ' HG22 ' A' ' 30' ' ' THR . 2.4 m -124.19 -69.27 0.82 Allowed 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 178.883 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.773 HG22 ' C ' ' A' ' 29' ' ' SER . 0.0 OUTLIER 163.73 -65.71 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 122.02 0.914 . . . . 0.0 109.345 179.113 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.75 ' H ' HG23 ' A' ' 30' ' ' THR . 3.3 p30 175.11 32.01 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.81 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.723 HG23 ' C ' ' A' ' 31' ' ' ASN . 2.6 t 76.55 48.57 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 CA-C-O 121.299 0.571 . . . . 0.0 109.776 -178.755 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 34' ' ' SER . . . -151.92 41.77 0.72 Allowed Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.889 -1.285 . . . . 0.0 109.889 -179.894 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.476 ' O ' ' HB3' ' A' ' 35' ' ' ASN . 56.5 m 56.0 -88.49 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.115 -1.227 . . . . 0.0 110.751 179.708 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.711 ' HB3' HG21 ' A' ' 30' ' ' THR . 0.2 OUTLIER 61.24 156.62 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.164 -0.96 . . . . 0.0 110.023 -179.751 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.575 HG23 ' O ' ' A' ' 36' ' ' THR . 3.4 t -51.06 88.25 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.278 -0.889 . . . . 0.0 110.313 -179.891 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.515 ' N ' ' O ' ' A' ' 35' ' ' ASN . 30.6 p90 . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.278 179.98 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.234 0.54 . . . . 1.5 110.487 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' HB2' ' A' ' 7' ' ' CYS . 33.7 m -142.72 -111.98 0.12 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.371 -0.831 . . . . 1.5 109.834 179.671 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' A' ' 4' ' ' THR . 12.7 t-20 -155.87 15.35 0.35 Allowed 'General case' 0 N--CA 1.487 1.425 0 O-C-N 120.917 -1.114 . . . . 3.2000000000000002 110.376 179.995 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.864 ' O ' ' HB3' ' A' ' 8' ' ' ALA . 2.3 m 74.42 -82.37 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.3 0 O-C-N 121.126 -0.983 . . . . 2.5 110.17 -179.801 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.487 ' O ' ' HB ' ' A' ' 9' ' ' THR . . . -46.55 -20.35 0.12 Allowed 'General case' 0 C--N 1.296 -1.728 0 O-C-N 120.691 -1.255 . . . . 2.8999999999999999 108.565 178.114 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.503 ' N ' ' O ' ' A' ' 4' ' ' THR . 18.9 m -90.92 -83.33 0.27 Allowed 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.349 -0.844 . . . . 3.3999999999999999 110.322 179.658 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.496 ' N ' HG22 ' A' ' 6' ' ' THR . 1.3 m -60.39 -27.11 67.18 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.311 -0.868 . . . . 2.0 109.986 -179.819 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.864 ' HB3' ' O ' ' A' ' 4' ' ' THR . . . -77.54 -47.75 18.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 118.826 -1.15 . . . . 1.3999999999999999 109.618 179.572 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.487 ' HB ' ' O ' ' A' ' 5' ' ' ALA . 30.9 m -66.87 -22.9 65.97 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 118.626 -1.23 . . . . 1.6000000000000001 108.891 179.017 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.516 ' NE2' ' HA ' ' A' ' 10' ' ' GLN . 9.6 mm-40 -86.44 -16.73 36.23 Favored 'General case' 0 C--N 1.308 -1.204 0 O-C-N 121.361 -0.837 . . . . 1.6000000000000001 109.259 179.024 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.57 ' O ' ' CE2' ' A' ' 15' ' ' PHE . 0.0 OUTLIER -91.23 -44.4 9.24 Favored 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 106.037 -1.838 . . . . 1.3 106.037 178.156 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.544 ' HA ' ' CD2' ' A' ' 15' ' ' PHE . 11.1 mt -66.27 -37.76 86.23 Favored 'General case' 0 C--N 1.295 -1.763 0 CA-C-N 114.508 -1.224 . . . . 2.1000000000000001 109.188 177.834 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 16' ' ' LEU . . . -70.94 -29.12 65.06 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.457 -0.777 . . . . 1.5 109.059 178.871 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 2.6 t-20 -60.66 -45.42 94.21 Favored 'General case' 0 N--CA 1.486 1.327 0 N-CA-C 108.525 -0.917 . . . . 2.6000000000000001 108.525 179.027 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.57 ' CE2' ' O ' ' A' ' 11' ' ' ARG . 3.0 m-85 -68.0 -20.49 65.03 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.893 -1.151 . . . . 2.1000000000000001 107.893 178.379 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.538 ' O ' ' CB ' ' A' ' 20' ' ' SER . 2.9 tp -60.0 -46.97 87.72 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.8 -0.76 . . . . 2.2999999999999998 109.334 179.302 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.1 -45.71 15.03 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.439 -0.788 . . . . 6.2000000000000002 110.454 179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.465 ' O ' ' HB2' ' A' ' 22' ' ' ASN . 7.2 m170 -64.14 -44.95 90.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.379 -0.825 . . . . 4.2000000000000002 110.766 -179.432 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.533 ' CB ' ' O ' ' A' ' 15' ' ' PHE . 1.0 OUTLIER -78.31 -40.42 36.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.243 -0.91 . . . . 9.0999999999999996 110.64 -179.397 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.538 ' CB ' ' O ' ' A' ' 16' ' ' LEU . 2.9 t -46.45 -40.51 12.4 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.238 -0.914 . . . . 10.0 110.588 -179.688 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -90.4 -35.9 14.91 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.221 -0.924 . . . . 7.7000000000000002 111.402 -179.119 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.48 ' O ' HG12 ' A' ' 26' ' ' ILE . 0.9 OUTLIER -78.39 -50.39 11.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.047 -1.033 . . . . 9.0999999999999996 110.783 -179.328 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.469 ' HB3' ' O ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -60.28 -21.83 62.39 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.304 -0.872 . . . . 9.0999999999999996 110.207 -179.611 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -89.85 -23.66 32.33 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 109.61 -1.396 . . . . 7.0999999999999996 109.61 -179.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.741 ' C ' HD13 ' A' ' 26' ' ' ILE . . . -74.16 -24.29 59.38 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.263 -1.14 . . . . 25.0 110.363 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ILE . . . . . 0.842 ' N ' HD13 ' A' ' 26' ' ' ILE . 1.8 mm -91.95 -44.84 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 N-CA-C 107.921 -1.14 . . . . 5.9000000000000004 107.921 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -51.82 -23.76 5.17 Favored 'General case' 0 C--N 1.297 -1.696 0 N-CA-C 107.115 -1.439 . . . . 5.9000000000000004 107.115 176.206 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 25' ' ' ALA . 5.4 m -73.61 -5.15 38.54 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.349 -0.841 . . . . 30.0 110.152 179.237 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 5.8 m -168.41 62.43 0.06 Allowed 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.17 -0.957 . . . . 16.699999999999999 110.661 -179.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.581 HG23 ' H ' ' A' ' 31' ' ' ASN . 1.5 t -123.33 -49.38 1.93 Allowed 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.381 -0.824 . . . . 11.1 109.587 179.284 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.796 ' O ' HG22 ' A' ' 32' ' ' VAL . 41.9 p-10 173.55 -24.63 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 116.035 -0.53 . . . . 16.699999999999999 110.082 179.434 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.796 HG22 ' O ' ' A' ' 31' ' ' ASN . 2.1 m 44.69 25.97 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.318 -0.863 . . . . 16.699999999999999 109.247 -178.905 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' N ' ' O ' ' A' ' 31' ' ' ASN . . . 88.77 106.07 1.04 Allowed Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.179 -1.568 . . . . 16.699999999999999 109.179 -179.574 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.5 m -149.13 -36.51 0.17 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.028 -1.278 . . . . 12.5 110.911 -179.633 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -125.54 177.68 6.07 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.183 -0.948 . . . . 20.0 110.595 -179.636 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.0 p -78.9 91.49 4.8 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.282 -0.886 . . . . 30.0 110.149 -179.987 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.489 ' C ' ' CD1' ' A' ' 37' ' ' TYR . 18.3 p90 . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 118.013 -0.994 . . . . 30.0 110.222 -179.973 . . . . . . . . 1 1 . 1 stop_ save_